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MIC Scientific Ltd.

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Profile: MIC Scientific Ltd. offers fine chemicals such as heterocyclic & aromatic compounds, pyridines, pyrimidines, indoles and phenylboronic acids. Our phenylboronic acid compounds are 2-chlorophenylboronic acid, 2-acetylphenylboronic acid, 2-isopropylphenylboronic acid, 5-fluoro-2-methylbenzeneboronic acid and 2-methylphenylboronic acid. Our piperazine compounds are 1-(4-trifluoromethylphenyl)piperazine, N-t-butylpiperazine, 4-boc-3-methyl piperazine, (S)-4-N-boc-2-methylpiperazine and 4-N-boc-piperazine-2-carboxylic acid.

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• L(-)-Mandelic Acid
IUPAC Name: (2S)-2-hydroxy-2-phenylacetic acid | CAS Registry Number: 17199-29-0
Synonyms: L-mandelic acid, (S)-Mandelic acid, (S)-Mandelate, D-Mandelic acid, (S)-Mandelsaeure, L-()-Mandelic acid, MANDELIC ACID, S(+)-Mandelic Acid, (S)-()-Mandelic acid, Hydroxy(phenyl)acetic acid, M2004_ALDRICH, (S)-2-Hydroxy-2-phenylacetate, (S)-mandelic acid, MLS000069517, L-(+)-MANDELIC ACID, (S)-2-Hydroxy-2-phenylacetic acid, 63462_FLUKA, CHEBI:32800, (2S)-hydroxy(phenyl)acetic acid, CPD-122

Molecular Formula: C8H8O3Molecular Weight: 152.147320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IWYDHOAUDWTVEP-ZETCQYMHSA-N

• L-Norvaline
IUPAC Name: (2S)-2-aminopentanoic acid | CAS Registry Number: 6600-40-4
Synonyms: norvaline, L-norvaline, Norvaline, L-, Norvaline (VAN), 2-Aminovaleric acid, L-2-Aminovaleric acid, L-2-aminopentanoic acid, 2-Aminopentanoic acid, (S)-2-Aminopentanoic acid, L-Norvaline (9CI), 2S-amino-pentanoic acid, Valeric acid, 2-amino-, (S)-2-Aminovaleric acid, Pentanoic acid, 2-amino-, alpha-L-Aminopentanoic acid, (2S)-2-aminopentanoic acid, N7627_SIGMA, 2-AMINO-PENTANOIC ACID, (S)-()-2-Aminopentanoic acid, CHEBI:18314

Molecular Formula: C5H11NO2Molecular Weight: 117.146340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SNDPXSYFESPGGJ-BYPYZUCNSA-N

• L-Phenylalaninol
IUPAC Name: 2-amino-3-phenylpropan-1-ol | CAS Registry Number: 3182-95-4
Synonyms: S-Phenylalaninol, Phenylalaninol, (S)-2-Benzylethanolamine, (S)-beta-Aminobenzenepropanol, Benzenepropanol, beta-amino-, L-2-Amino-3-phenyl-1-propanol, L-2-Amino-3-phenylpropan-1-ol, 2-Amino-3-phenyl-1-propanol, (R)-2-Amino-3-phenylpropanol, EINECS 221-674-4, 1-Propanol, 2-amino-3-phenyl-, L-, NSC20899, EINECS 226-086-1, Benzenepropanol, beta-amino-, (S)-, NSC 20899, NSC133421, Benzenepropanol, .beta.-amino-, (R)-, NCGC00095352-01, (S)-(-)-2-Amino-3-phenyl-1-propanol, LS-121681

Molecular Formula: C9H13NOMolecular Weight: 151.205620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: STVVMTBJNDTZBF-UHFFFAOYSA-N

• L-Pipecolic acid
IUPAC Name: piperidine-2-carboxylic acid | CAS Registry Number: 3105-95-1
Synonyms: Pipecolic acid, Homoproline, Pipecolinic acid, pipecolate, Dihydrobaikiane, l-Pipecolic acid, L-pipecolate, Piperolinic acid, homopipecolic acid, Hexahydropicolinic acid, Pipecolic acid, L-, L-Pipecolinic acid, 2-PIPERIDINECARBOXYLIC ACID, DL-Pipecolinic acid, .alpha.-Pipecolinic acid, Acide pipecolique [French], Pipecolic acid free base, Pipecolic acid, L-(-)-, Pipecolic acid, (S)-(-)-, pipecolic acid, ion (1-)

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HXEACLLIILLPRG-UHFFFAOYSA-N

• L-Prolinamide
IUPAC Name: (2S)-pyrrolidine-2-carboxamide | CAS Registry Number: 7531-52-4
Synonyms: Prolinamide, L-prolinamide, (S)-Prolinamide, (S)-Pyrrolidine-2-carboxamide, 287059_ALDRICH, 81722_FLUKA, EINECS 231-397-0, SBB006531, NCGC00159402-02, TL8005159, DPR

Molecular Formula: C5H10N2OMolecular Weight: 114.145700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VLJNHYLEOZPXFW-BYPYZUCNSA-N

• L-Proline, 1-[1-(phenylmethyl)-4-Piperidinyl]-
IUPAC Name: (2S)-1-(1-benzylpiperidin-4-yl)pyrrolidine-2-carboxylic acid | CAS Registry Number: 669713-67-1
Synonyms: (S)-N-[4'-benzyl)piperidino]proline, (S)-1-(1-benzylpiperidin-4-yl)pyrrolidine-2-carboxylic acid, (s)-n-[(4'-benzyl)piperidino] proline, (S)-1-(1-Benzylpiperidin-4-yl)-pyrrolidine-2-carboxylic acid, (S)-1-(1-BENZYL-PIPERIDIN-4-YL)-PYRROLIDINE-2-CARBOXYLIC ACID, AC1MBU2R, CTK7I3289, SBB067693, AKOS015912898, AB09339, AG-A-07920, (s)-n-[(4'-benzyl)piperidino]proline, (s)-n-[4'-(benzyl)piperidino]proline, AK-45157, A13056, I14-4908, 1-[1-(PHENYLMETHYL)-4-PIPERIDINYL]-L-PROLINE, L-PROLINE, 1-[1-(PHENYLMETHYL)-4-PIPERIDINYL]-, (2S)-1-(1-benzylpiperidin-4-yl)pyrrolidine-2-carboxylic acid

Molecular Formula: C17H24N2O2Molecular Weight: 288.384660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JYLMRBVDIKEXAY-INIZCTEOSA-N

• L-Pyroglutaminol
IUPAC Name: (5S)-5-(hydroxymethyl)pyrrolidin-2-one | CAS Registry Number: 17342-08-4
Synonyms: 366366_ALDRICH, 5-(hydroxymethyl)pyrrolidin-2-one, SBB004302, ZINC04202249, 2-Pyrrolidinone, 5-(hydroxymethyl)-, S)-5-(Hydroxymethyl)-2-pyrrolidinone, (S)-5-(Hydroxymethyl)-2-pyrrolidinone, TL8006226, InChI=1/C5H9NO2/c7-3-4-1-2-5(8)6-4/h4,7H,1-3H2,(H,6,8

Molecular Formula: C5H9NO2Molecular Weight: 115.130460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HOBJEFOCIRXQKH-BYPYZUCNSA-N

• m-Chloro Propiophenone
IUPAC Name: 1-(3-chlorophenyl)propan-1-one | CAS Registry Number: 34841-35-5
Synonyms: 3'-Chloropropiophenone, m-Chloropropiophenone, 248193_ALDRICH, EINECS 252-242-3, 1-Propanone, 1-(3-chlorophenyl)-, ZINC00407109, ST5405393, TL8002590

Molecular Formula: C9H9ClOMolecular Weight: 168.620160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PQWGFUFROKIJBO-UHFFFAOYSA-N

• m-Dibromobenzene
IUPAC Name: 1,3-dibromobenzene | CAS Registry Number: 108-36-1
Synonyms: Benzene, m-dibromo-, Benzene, 1,3-dibromo-, 1,3-DIBROMOBENZENE, 194395_ALDRICH, CHEBI:37151, EINECS 203-574-2, CID7927, LS-29659, ST5406440, InChI=1/C6H4Br2/c7-5-2-1-3-6(8)4-5/h1-4

Molecular Formula: C6H4Br2Molecular Weight: 235.903960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: JSRLURSZEMLAFO-UHFFFAOYSA-N

• M-Difluorobenzene
IUPAC Name: 1,3-difluorobenzene | CAS Registry Number: 372-18-9
Synonyms: m-Difluorobenzene, Benzene, m-difluoro-, 1,3-DIFLUOROBENZENE, Benzene, 1,3-difluoro-, meta-Difluorobenzene, 1,3-Difluorbenzol, Ambap5726, WLN: FR CF, D102008_ALDRICH, CHEBI:38584, EINECS 206-746-5, CID9741, NSC 10285, Benzene, 1,3-difluoro- (9CI), JRD-0432, NSC10285, LS-29834, TL8002738

Molecular Formula: C6H4F2Molecular Weight: 114.092766 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UEMGWPRHOOEKTA-UHFFFAOYSA-N

• Methyl (E)-4-chloro-3-methoxy-2-butanoate
IUPAC Name: methyl (E)-4-chloro-3-methoxybut-2-enoate | CAS Registry Number: 110104-60-4
Synonyms: HedL`LxPbDee{jZZAFH, EINECS 285-842-9, ZINC02545267, Methyl 4-chloro-3-methoxy-2-butenoate, 85153-60-2

Molecular Formula: C6H9ClO3Molecular Weight: 164.586860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: JNYMRXDQVPIONI-HWKANZROSA-N

• Methyl (R)-2-Hydroxybutyrate
IUPAC Name: methyl (2R)-2-hydroxybutanoate | CAS Registry Number: 73349-07-2
Synonyms: AG-G-89922, (S)-Methyl-2-hydroxybutanoate, CTK5D7820, METHYL (R)-2-HYDROXYBUTYRATE, AKOS006291230, Butanoicacid, 2-hydroxy-, methyl ester, (R)-, Butanoic acid,2-hydroxy-, methyl ester, (2R)-, M111027

Molecular Formula: C5H10O3Molecular Weight: 118.131100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DDMCDMDOHABRHD-SCSAIBSYSA-N

• Methyl (S)-2-Hydroxybutyrate
IUPAC Name: methyl (2S)-2-hydroxybutanoate | CAS Registry Number: 73349-08-3
Synonyms: (S)-Methyl 2-hydroxybutanoate, AG-G-89923, (R)-Methyl-2-hydroxybutanoate, CTK5D7821, METHYL (S)-2-HYDROXYBUTYRATE, AK135165, KB-211826, Butanoic acid,2-hydroxy-, methyl ester, (2S)-, M111026, Butanoicacid, 2-hydroxy-, methyl ester, (S)-;(S)-2-Hydroxybutyric acid methyl ester;Methyl (2S)-hydroxybutyrate;Methyl (S)-b-hydroxybutyrate;

Molecular Formula: C5H10O3Molecular Weight: 118.131100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DDMCDMDOHABRHD-BYPYZUCNSA-N

• Methyl 2-Chloropyrimidine-4-Carboxylate
IUPAC Name: methyl 2-chloropyrimidine-4-carboxylate | CAS Registry Number: 149849-94-5
Synonyms: Methyl 2-chloropyrimidine-4-carboxylate, 2-Chloro-4-(methoxycarbonyl)pyrimidine, 4-Pyrimidinecarboxylicacid, 2-chloro-, methyl ester, ACMC-209z05, CTK4C6395, ANW-49635, SBB088698, ZINC34936285, AKOS006346745, AG-D-96258, MO08502, PB23898, QC-5729, RP02748, AK-33388, BR-33388, EN000167, HC210425, KB-53889, FT-0646922

Molecular Formula: C6H5ClN2O2Molecular Weight: 172.569100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: GGTNGWOGJHJQCL-UHFFFAOYSA-N

• Methyl 5-Bromo-2-Hydroxypyrimidine-4-Carboxylate
IUPAC Name: methyl 5-bromo-2-oxo-1H-pyrimidine-6-carboxylate | CAS Registry Number: 71933-03-4
Synonyms: Methyl 5-bromo-2-hydroxypyrimidine-4-carboxylate, CTK8B9948, ANW-63702, AKOS016003650, AK-76224, HC210429, KB-203058

Molecular Formula: C6H5BrN2O3Molecular Weight: 233.019500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LQTKGJRZBOYLEY-UHFFFAOYSA-N

• Methyl pyrimidine-5-carboxylate
IUPAC Name: methyl pyrimidine-5-carboxylate | CAS Registry Number: 34253-01-5
Synonyms: NCIOpen2_000892, methyl 5-pyrimidinecarboxylate, NSC77421, CID253902, AN-584/41341491

Molecular Formula: C6H6N2O2Molecular Weight: 138.124040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: XMVNUAHPLDBEJH-UHFFFAOYSA-N

• N-Boc-trans-4-hydroxy-L-prolinol
IUPAC Name: tert-butyl (2S,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate | CAS Registry Number: 61478-26-0
Synonyms: AG-G-24073, Boc-trans-4-hydroxy-L-prolinol, (2S,4R)-1-Boc-4-hydroxy-2-(hydroxymethyl)pyrrolidine, (2S,4R)-1-(tert-Butoxycarbonyl)-4-hydroxy-2-(hydroxymethyl)pyrrolidine, BOC-HYP-OL, (2S,4R)-TERT-BUTYL 4-HYDROXY-2-(HYDROXYMETHYL)PYRROLIDINE-1-CARBOXYLATE, tert-butyl (2S,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate, trans-4-Hydroxy-L-prolinol, N-BOC protected, SureCN584549, KSC497A5J, 546992_ALDRICH, (2S,4R)-tert-butyl4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate, CTK3J7054, UFJNFQNQLMGUTQ-JGVFFNPUSA-, MolPort-003-936-400, ANW-33826, RW1167, ZINC00404083, N-TBOC-TRANS-L-HYDROXYPROLINOL, AKOS015836447

Molecular Formula: C10H19NO4Molecular Weight: 217.262160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: UFJNFQNQLMGUTQ-JGVFFNPUSA-N

• N-Butyl (S)-2-Hydroxybutyrate
IUPAC Name: butyl (2S)-2-hydroxybutanoate | CAS Registry Number: 132513-51-0
Synonyms: (S)-Butyl 2-hydroxybutanoate, (S)-2-Hydroxybutanoic acid n-butyl ester, CTK8B5445, ANW-48763, N-BUTYL(S)-2-HYDROXYBUTYRATE, AK-57865, BR-57865, KB-211685, X9834, M111030

Molecular Formula: C8H16O3Molecular Weight: 160.210840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YFFBWGUXPFAXRS-ZETCQYMHSA-N

• N-Methyl-3-cyano-6-hydroxy-4-methyl-2-pyridone
IUPAC Name: 6-hydroxy-1,5-dimethyl-2-oxopyridine-3-carbonitrile | CAS Registry Number: 27074-03-9
Synonyms: EINECS 248-209-8, BRN 0474348, 1,4-Dimethyl-3-cyano-6-hydroxypyrid-2-one, 1,2-Dihydro-1,4-dimethyl-6-hydroxy-2-oxonicotinonitrile, 1,2-Dihydro-6-hydroxy-1,4-dimethyl-2-oxonicotinonitrile, 3-Pyridinecarbonitrile, 1,2-dihydro-1,4-dimethyl-2-oxo-, Nicotinonitrile, 1,2-dihydro-1,4-dimethyl-6-hydroxy-2-oxo-, Nicotinonitrile, 1,2-dihydro-6-hydroxy-1,4-dimethyl-2-oxo-, 3-Pyridinecarbonitrile, 1,2-dihydro-6-hydroxy-1,4-dimethyl-2-oxo-

Molecular Formula: C8H8N2O2Molecular Weight: 164.161320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ZVEMMMAGDMWTFC-UHFFFAOYSA-N

• N-t-Boc-4-oxo-L-proline
IUPAC Name: (2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxopyrrolidine-2-carboxylic acid | CAS Registry Number: 84348-37-8
Synonyms: N-Boc-4-oxo-L-proline, N-t-boc-4-oxo-L-proline, SBB067204, AG-H-36948, (S)-1-(Tert-Butoxycarbonyl)-4-oxopyrrolidine-2-carboxylic acid, (2S)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-oxo-2-pyrrolidinecarboxylic acid, (2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanylidene-pyrrolidine-2-carboxylic acid, Boc-L-Pro(4-oxo), PubChem18727, SureCN204965, KSC496K0R, (2S)-1-(tert-butoxycarbonyl)-4-oxopyrrolidine-2-carboxylic acid, 681202_ALDRICH, CTK3J6508, MolPort-000-002-200, ACT02238, ANW-37761, FC1252, N-tert-butoxycabonyl-4-oxo-L-proline, AKOS015836547

Molecular Formula: C10H15NO5Molecular Weight: 229.229800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: CKYGSXRXTIKGAJ-ZETCQYMHSA-N

• Nipecotic acid, S(+)-
IUPAC Name: (3S)-piperidine-3-carboxylic acid | CAS Registry Number: 59045-82-8
Synonyms: (S)-(+)-Nipecotic acid, (S)-Piperidine-3-carboxylic acid, (+)-nipecotic acid, (3S)-piperidine-3-carboxylic acid, (S)-(+)-3-Piperidinecarboxylic acid, CHEBI:222169, (S)-(+)-Nipecoticacid, L(+)-NIPECOTIC ACID, (R)-nipecotic acid, (S)-nipecotic acid, AG-G-09952, L-PIPERIDINE-3-CARBOXYLIC ACID, (3S)-(+)-piperidine-3-carboxylic acid, (S)-3-Piperidine-3-Carboxylic Acid, D-piperidine-3-carboxylic acid, PubChem5657, (3S)-nipecotic acid, Tocris-0236, NIP-OH, L-NIPECOTIC ACID

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XJLSEXAGTJCILF-YFKPBYRVSA-N

• Nitroxylol
IUPAC Name: 1,3-dimethyl-5-nitrobenzene | CAS Registry Number: 99-12-7
Synonyms: 5-Nitro-m-xylene, 3,5-Dimethylnitrobenzene, m-Xylene, 5-nitro-, 3,5-Dimethyl-1-nitrobenzene, 1,3-DIMETHYL-5-NITROBENZENE, CCRIS 3121, Benzene, 1,3-dimethyl-5-nitro-, NSC5403, 137855_ALDRICH, 45941_RIEDEL, m-Xylene, 5-nitro- (8CI), NSC 5403, EINECS 202-732-8, CID7426, LTBB004390, ZINC01686925, LS-2058, NCGC00091184-01, I01-3646, InChI=1/C8H9NO2/c1-6-3-7(2)5-8(4-6)9(10)11/h3-5H,1-2H

Molecular Formula: C8H9NO2Molecular Weight: 151.162560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BYFNZOKBMZKTSC-UHFFFAOYSA-N

• o-Chlorotrityl Chloride
IUPAC Name: 1-chloro-2-[chloro-di(phenyl)methyl]benzene | CAS Registry Number: 42074-68-0
Synonyms: 2-Chlorotrityl chloride, 532282_ALDRICH, 532290_ALDRICH, 532304_ALDRICH, 554790_ALDRICH, 26568_FLUKA, 26569_FLUKA, 73311_FLUKA, EINECS 255-647-3, Chloro(2-chlorophenyl)diphenylmethane, 2-Chlorotrityl chloride, polymer-bound, 1-Chloro-2-(chlorodiphenylmethyl)benzene, StratoSpheres PL-Cl-Trt-Cl (2-chlorotrityl Cl) resin, 2,alpha-Dichlorobenzhydryl-polystyrene crosslinked with divinylbenzene

Molecular Formula: C19H14Cl2Molecular Weight: 313.220460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: JFLSOKIMYBSASW-UHFFFAOYSA-N

• O-Dibromobenzene
IUPAC Name: 1,2-dibromobenzene | CAS Registry Number: 583-53-9
Synonyms: o-Dibromobenzene, Benzene, o-dibromo-, Benzene, 1,2-dibromo-, 1,2-DIBROMOBENZENE, Benzene, dibromo-, DIBROMOBENZENE, ortho-Dibromobenzene, BENZENE,1,2-DIBROMO, D39002_ALDRICH, Benzene, o-dibromo- (8CI), 33971_FLUKA, CHEBI:37152, EINECS 209-507-3, EINECS 247-544-7, NSC 60643, UN2711, CID11414, NSC60643, AI3-10009, LS-29658

Molecular Formula: C6H4Br2Molecular Weight: 235.903960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WQONPSCCEXUXTQ-UHFFFAOYSA-N

• O-Phthalaldehyde
IUPAC Name: phthalaldehyde | CAS Registry Number: 643-79-8
Synonyms: o-Phthalaldehyde, Phthalic aldehyde, o-Phthaldialdehyde, phtharal, Phthalic dialdehyde, PHTHALALDEHYDE, Disopa, Phthaldialdehyde, o-Phthaldehyde, Phthalyldicarboxaldehyde, 1,2-Benzenedicarboxaldehyde, Phtharal (JAN), ortho-Phthalaldehyde, Orthophthaldialdehyde, Disopa (TN), Phtalaldehydes [French], Phthalic dicarboxaldehyde, ortho-Phthalic Aldehyde, Phthaldialdehyde Reagent, o-Phthalic dicarboxaldehyde

Molecular Formula: C8H6O2Molecular Weight: 134.132040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZWLUXSQADUDCSB-UHFFFAOYSA-N

• p-Xylene Glycol
IUPAC Name: [4-(hydroxymethyl)phenyl]methanol | CAS Registry Number: 589-29-7
Synonyms: p-Xylene glycol, p-Xylyl alcohol, p-Xylylene glycol, p-Xylylenediol, p-Benzenedimethanol, 1,4-BENZENEDIMETHANOL, Terephthalyl alcohol, 1,4-Xylylene glycol, 1,4-Dimethylolbenzene, p-Phenylenedimethanol, p-Xylylene dialcohol, p-Phenylene dicarbinol, 1,4-phenylenedimethanol, p-Bis(hydroxymethyl)benzene, alpha,alpha'-p-Xylenediol, 1,4-Bis(hydroxymethyl)benzene, p-Xylene-alpha,alpha'-diol, p-Xylene-.alpha.,.alpha.'-diol, p-(Hydroxymethyl)benzyl alcohol, p-Xylylene-alpha,alpha'-diol

Molecular Formula: C8H10O2Molecular Weight: 138.163800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: BWVAOONFBYYRHY-UHFFFAOYSA-N

• Phenylephrine
IUPAC Name: 3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol | CAS Registry Number: 59-42-7
Synonyms: phenylephrine, m-Oxedrine, Metaoxedrinum, Metasynephrine, Neosynephrine, Metaoxedrin, Metaoxedrine, Metasympatol, Visadron, Mesaton, Mezaton, m-Sympatol, Isophrin, Mesatone, Mesatonum, m-Synephrine, m-Sympathol, Isophrim, L-Phenylephrine, Neo-Synephrine

Molecular Formula: C9H13NO2Molecular Weight: 167.205020 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: SONNWYBIRXJNDC-VIFPVBQESA-N

• Phthalide
IUPAC Name: 3H-2-benzofuran-1-one | CAS Registry Number: 87-41-2
Synonyms: PHTHALIDE, Phthalolactone, 1-Phthalanone, 1(3H)-Isobenzofuranone, 1-Isobenzofuranone, 3H-isobenzofuran-1-one, 2-Benzofuran-1(3H)-one, CCRIS 3598, P39605_ALDRICH, NSC 1469, 79770_FLUKA, EINECS 201-744-0, CID6885, NSC1469, BRN 0114632, ZINC00154698, 2-Hydroxymethylbenzoic acid, gamma-lactone, AI3-05785, LS-109380, 2-Hydroxymethylbenzoic acid, .gamma.-lactone

Molecular Formula: C8H6O2Molecular Weight: 134.132040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WNZQDUSMALZDQF-UHFFFAOYSA-N

• Pyridoxal 5'-phosphate
IUPAC Name: (4-formyl-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate | CAS Registry Number: 853645-22-4
Synonyms: pyridoxal phosphate, Codecarboxylase, Biosechs, pyridoxal 5-phosphate, Vitazechs, Pyridoxal P, Hairoxal, Pyromijin, Himitan, Pidopidon, Hiadelon, Sechvitan, Piodel, Pydoxal, Phosphopyridoxal, Apolon B6, pyridoxal-P, HI-Pyridoxin, Pal-P, pyridoxal 5'-phosphate

Molecular Formula: C8H10NO6PMolecular Weight: 247.141862 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: NGVDGCNFYWLIFO-UHFFFAOYSA-N

• Pyrimidine, 5-bromo-2-methyl-
IUPAC Name: 5-bromo-2-methylpyrimidine | CAS Registry Number: 7752-78-5
Synonyms: 5-Bromo-2-methylpyrimidine, 2-Methyl-5-bromopyrimidine, 5-Bromo-2-methyl-pyrimidine, AG-H-10316, PYRIMIDINE, 5-BROMO-2-METHYL-, PubChem15231, ACMC-1BM3H, SureCN508361, AC1Q2P1Z, 5-Bromo-2-methylpyrimidine,, AGN-PC-00197I, CTK3J4230, MolPort-019-877-921, ANW-37048, ZINC15446549, AKOS005258596, HP21361, OR59447, PB18804, QC-4144

Molecular Formula: C5H5BrN2Molecular Weight: 173.010600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NEDJTEXNSTUKHW-UHFFFAOYSA-N

• Pyrimidine-5-carboxylic acid
IUPAC Name: pyrimidine-5-carboxylic acid | CAS Registry Number: 4595-61-3
Synonyms: CID78346, EINECS 224-994-2, P2410G1, ST5340242, TL8003190, AA-516/30012043

Molecular Formula: C5H4N2O2Molecular Weight: 124.097460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IIVUJUOJERNGQX-UHFFFAOYSA-N

• Quinalizarin
IUPAC Name: 1,2,5,8-tetrahydroxyanthracene-9,10-dione | CAS Registry Number: 81-61-8
Synonyms: quinalizarin, Khinalizarin, Alizarinbordeaux, Quinalizarine, Alizarine Bordeaux B, Alizarine Bordeaux, Alizarinbordeux, Mordant Violet 26, Alizarin Bordeaux BD, C.I. Mordant Violet 26, Spectrum_000952, 1,2,5,8-Tetrahydroxyanthraquinone, Spectrum2_001362, Spectrum3_000778, Spectrum4_000998, Spectrum5_000846, NSC4896, 1,2,5,8-Tetrahydroxyanthracinon, CCRIS 5598, Anthraquinone, 1,2,5,8-tetrahydroxy-

Molecular Formula: C14H8O6Molecular Weight: 272.209720 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: VBHKTXLEJZIDJF-UHFFFAOYSA-N

• R-(+)-Propylenediamine Dihydrochloride
IUPAC Name: (2R)-propane-1,2-diamine;dihydrochloride | CAS Registry Number: 19777-67-4
Synonyms: (R)-(+)-1,2-Diaminopropane dihydrochloride, (R)-1,2-Diaminopropane 2HCl, (R)-1,2-Diaminopropane Dihydrochloride, (R)-(+)-Propylenediamine dihydrochloride, ST51037664, 1,2-Propanediamine dihydrochloride, (R)-1,2-Diaminopropane Di hydrochloride, 412554_ALDRICH, 82253_FLUKA, CTK8B1122, MolPort-003-932-227, ACT06789, (R)-Propylenediamine Dihydrochloride, ANW-23771, AKOS015845557, AKOS016015887, AG-E-44412, RP21113, (R)-1,2-Propanediamine Dihydrochloride, AK-45035

Molecular Formula: C3H12Cl2N2Molecular Weight: 147.046780 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 2

InChIKey: AEIAMRMQKCPGJR-HWYNEVGZSA-N

• R-(-)-2-Chloromandelic Acid
IUPAC Name: (2R)-2-(2-chlorophenyl)-2-hydroxyacetic acid | CAS Registry Number: 52950-18-2
Synonyms: (R)-(-)-2-Chloromandelic acid, (R)-2-Chloromandelic acid, (R)-2-(2-Chlorophenyl)-2-hydroxyacetic acid, (2R)-2-(2-chlorophenyl)-2-hydroxyacetic acid, PubChem5742, AC1MBZCR, SureCN24732, 2-Chloro-D-mandelic Acid, AC1Q59EN, KSC914S2L, 478873_ALDRICH, CTK8B4925, MolPort-002-344-079, ACN-S004242, ANW-46708, RP24670, AC-11667, AK-81922, TL8003481, (R)-2-Chloro-alpha-hydroxyphenylacetic Acid

Molecular Formula: C8H7ClO3Molecular Weight: 186.592380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: RWOLDZZTBNYTMS-SSDOTTSWSA-N

• R-(-)-5-(2-Amino-Propyl)-2-Methoxy-Benzenesulfonamide
IUPAC Name: 5-(2-aminopropyl)-2-methoxybenzenesulfonamide | CAS Registry Number: 112101-81-2
Synonyms: 5-(2-AMINOPROPYL)-2-METHOXYBENZENESULFONAMIDE, R-(-)-5-(2-Amino-propyl)-2-methoxybenzenesulfonamide, R-(-)-5-[2(2-Amino-2-Methyl)Ethyl]-2- Methory Benzene Sulfonamide, 112244-38-9, 5-[2-Aminopropyl]-2-methoxybenzenesulfonamide, AGN-PC-00LALO, ACMC-20a14k, Benzenesulfonamide,5-[(2R)-2-aminopropyl]-2-methoxy-, R-(-)-5-(2-Amino-propyl)-2-methoxy-benzenesulfonamide, SureCN1412240, 5-[(2R)-2-AMINOPROPYL]-2-METHOXYBENZENESULFONAMIDE, MolPort-003-848-659, ANW-51025, AKOS015914394, AC-5617, AK-25296, R253, KB-195581, 5-(2-Aminopropyl)-2-methoxybenzenesulphonamide, M-1660

Molecular Formula: C10H16N2O3SMolecular Weight: 244.310640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: IORITYIZDHJCGT-UHFFFAOYSA-N

• R-4-Benzyl-2-oxazolidinone
IUPAC Name: (4R)-4-(phenylmethyl)-1,3-oxazolidin-2-one | CAS Registry Number: 102029-44-7
Synonyms: MLS001242802, (R)-4-Benzyl-2-oxazolidinone, ZINC04284392, CID2734969, SMR000841429, TL806371, ST5405530

Molecular Formula: C10H11NO2Molecular Weight: 177.199840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OJOFMLDBXPDXLQ-SECBINFHSA-N

• R-4-Isopropyl-2-oxazolidinone
IUPAC Name: (4R)-4-propan-2-yl-1,3-oxazolidin-2-one | CAS Registry Number: 95530-58-8
Synonyms: 339946_ALDRICH, 59658_FLUKA, (R)-4-Isopropyl-2-oxazolidinone, 4-Isopropyl-1,3-oxazolidin-2-one, ZINC02539403, (R)-()-4-Isopropyl-2-oxazolidinone, 2-oxazolidinone, 4-(1-methylethyl)-, InChI=1/C6H11NO2/c1-4(2)5-3-9-6(8)7-5/h4-5H,3H2,1-2H3,(H,7,8

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YBUPWRYTXGAWJX-YFKPBYRVSA-N

• R-4-Phenyl-2-oxazolidinone
IUPAC Name: (4R)-4-phenyl-1,3-oxazolidin-2-one | CAS Registry Number: 90319-52-1
Synonyms: 402451_ALDRICH, ZINC00143125, (R)-(-)-4-Phenyl-2-oxazolidinone, TL8005811, (R)-(−)-4-Phenyl-2-oxazolidinone, A00134

Molecular Formula: C9H9NO2Molecular Weight: 163.173260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QDMNNMIOWVJVLY-QMMMGPOBSA-N

• R-Phenylglycinol (R-2-amino-2-phenylethanol)
IUPAC Name: 2-amino-2-phenylethanol | CAS Registry Number: 56613-80-0
Synonyms: beta-Aminophenethyl alcohol, Benzeneethanol, beta-amino-, 2-Amino-2-phenylethanol, ChemDiv2_003373, (R)-(-)-2-Phenylglycinol, Phenethyl alcohol, beta-amino-, d(-)-.alpha.-Phenylglycinol, (R)-beta-Aminophenethyl alcohol, alpha-Phenyl-alpha-amino-beta-oxyethane, Benzeneethanol, .beta.-amino-, (R)-, EINECS 260-287-5, NSC617248, NCI60_005172, LS-103052, 7568-92-5

Molecular Formula: C8H11NOMolecular Weight: 137.179040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IJXJGQCXFSSHNL-UHFFFAOYSA-N

• S(-)-3-Hydroxy-Y-Butyrolactone
IUPAC Name: (5S)-5-hydroxyoxolan-2-one | CAS Registry Number: 7331-52-4
Synonyms: ZINC04262540, CID2733691

Molecular Formula: C4H6O3Molecular Weight: 102.088640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FYNVARJNCVQAAI-VKHMYHEASA-N

• S-4-Isopropyl-2-oxazolidinone
IUPAC Name: (4S)-4-propan-2-yl-1,3-oxazolidin-2-one | CAS Registry Number: 17016-83-0
Synonyms: 298883_ALDRICH, 59660_FLUKA, ZINC04262265, (4S)-(-)-4-Isopropyl-2-oxazolidinone, TL8001333, (S)-(−)-4-Isopropyl-2-oxazolidinone

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YBUPWRYTXGAWJX-RXMQYKEDSA-N

• S-Phenylglycine methylester HCl
IUPAC Name: methyl (2S)-2-amino-2-phenylacetate;hydrochloride | CAS Registry Number: 15028-39-4
Synonyms: (S)-(+)-2-Phenylglycine methyl ester hydrochloride, SBB057682, (S)-2-PHENYLGLYCINE METHYL ESTER HYDROCHLORIDE, L-Phenylglycine methylester hydrochloride, 13226-98-7, H-PHG-OME HCL, SureCN852495, KSC491O4H, 308676_ALDRICH, CTK3J1743, MolPort-003-929-790, ANW-42528, AKOS015846000, AC-12927, AK-49410, AB1002043, FT-0627677, FT-0652100, V0867, V0870

Molecular Formula: C9H12ClNO2Molecular Weight: 201.650080 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DTHMTBUWTGVEFG-QRPNPIFTSA-N

• Santonin
IUPAC Name: (3S,3aS,5aS,9bS)-3,5a,9-trimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g][1]benzofuran-2,8-dione | CAS Registry Number: 481-06-1
Synonyms: santonin, alpha-Santonin, Semenen, Santoninic anhydride, (-)-Santonin, .alpha.-Santonin, Santonin (TN), (-)-Santonine, l-.alpha.-Santonin, SANTONINE, Santonin (JP15), ( )-alpha-Santonin, (-)-alpha-Santonin, Spectrum_000790, SpecPlus_000318, (-)-.alpha.-Santonin, Prestwick0_001070, Prestwick1_001070, Prestwick2_001070, Prestwick3_001070

Molecular Formula: C15H18O3Molecular Weight: 246.301620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XJHDMGJURBVLLE-BOCCBSBMSA-N

• Tert-butyl Methyl(s)-pyrrolidin-3-ylcarbamate
IUPAC Name: tert-butyl N-methyl-N-[(3S)-pyrrolidin-3-yl]carbamate | CAS Registry Number: 169750-01-0
Synonyms: (S)-TERT-BUTYL METHYL(PYRROLIDIN-3-YL)CARBAMATE, (S)-3-(N-Boc-N-methylamino)pyrrolidine, (S)-3-N-Boc-3-N-Methylaminopyrrolidine, (S)-3-(N-Bocmethylamino)pyrrolidine, (S)-3-(N-Boc-Methylamino)pyrrolidine, (S)-3-[N-(Tert-Butoxycarbonyl)-N-Methylamino]Pyrrolidine, Methyl-(S)-pyrrolidin-3-yl-carbamic acid tert-butyl ester, (S)-3-(N-Tert-Butoxycarbonyl-N-Methylamino)Pyrrolidine, tert-butyl N-methyl-N-[(3S)-pyrrolidin-3-yl]carbamate, PubChem11298, AC1OGP1Y, SureCN181909, Jsp003463, CTK3J6944, MolPort-003-985-818, ACT01701, ANW-47548, AKOS005259262, AM90327, PB29553

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XYKYUXYNQDXZTD-QMMMGPOBSA-N

• Tetrahydrofuran-2-Carboxylic Acid (3-Methylaminopropyl)amide
IUPAC Name: N-[3-(methylamino)propyl]oxolane-2-carboxamide | CAS Registry Number: 81403-67-0
Synonyms: Tetrahydrofuran-2-carboxylic acid (3-methylaminopropyl)amide, SureCN4234473, AKOS009618069, AK134574, KB-204744, FT-0655664, ST51054262, N-[3-(methylamino)propyl]-2-oxolanecarboxamide, N-[3-(methylamino)propyl]oxolane-2-carboxamide, A840120, I14-3642, N-(3-(Methylamino)propyl)tetrahydrofuran-2-carboxamide, 2-Furancarboxamide, tetrahydro-N-[3-(methylamino)propyl]-

Molecular Formula: C9H18N2O2Molecular Weight: 186.251420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AUXJTEANWWFSRR-UHFFFAOYSA-N

• Tetrahydrothiopyran-4-one S,S-dioxide
IUPAC Name: 1,1-dioxothian-4-one | CAS Registry Number: 17396-35-9
Synonyms: 4-Thiacyclohexanone dioxide, NCIOpen2_001700, NSC95668, ZINC01621344, BAS 01062707, 1,1-Dioxo-tetrahydro-thiopyran-4-one, 4H-Thiopyran-4-one, tetrahydro-, 1,1-dioxide, ST5245326, Tetrahydro-4H-thiopyran-4-one 1,1-dioxide, TL8001380, 1,1-Dioxo-tetrahydro-1lambda*6*-thiopyran-4-one

Molecular Formula: C5H8O3SMolecular Weight: 148.180220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XFMQGQAAHOGFQS-UHFFFAOYSA-N

• Thiazole-4-Carboxylic Acid
IUPAC Name: 1,3-thiazole-4-carboxylic acid | CAS Registry Number: 3973-08-8
Synonyms: 4-Thiazolecarboxylic acid, Thiazole-4-carboxylic acid, 633658_ALDRICH, 1,3-THIAZOLE-4-CARBOXYLIC ACID, NSC195467, SBB010166, DB03422, T2163G1, 2-oxo-3H-1,3-thiazole-4-carbaldehyde, BAS 07094730, AN-604/40744409

Molecular Formula: C4H3NO2SMolecular Weight: 129.137120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HMVYYTRDXNKRBQ-UHFFFAOYSA-N

• Trans-3-Aminocyclobutanecarboxylic Acid
IUPAC Name: 3-aminocyclobutane-1-carboxylic acid | CAS Registry Number: 74307-75-8
Synonyms: trans-3-Aminocyclobutanecarboxylic acid, cis-3-Aminocyclobutanecarboxylic acid, 74316-27-1, 3-aminocyclobutanecarboxylic acid, 3-Aminocyclobutane-1-carboxylic acid, cis-3-Amino-cyclobutanecarboxylic acid, 160191-58-2, Cyclobutanecarboxylic acid, 3-amino-, cis-, CIS-3-AMINOCYCLOBUTANE-CARBOXYLIC ACID, 3-amino-1-cyclobutanecarboxylic acid, 3-azanylcyclobutane-1-carboxylic acid, ACBGABA, SureCN295283, SureCN761864, AC1L4YJ7, SureCN4287590, CTK2H6998, CTK2H7457, CTK9A3530, MolPort-001-770-167

Molecular Formula: C5H9NO2Molecular Weight: 115.130460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: YRGRLZXBOJQQDP-UHFFFAOYSA-N

• Trihexyphenidyl
IUPAC Name: 1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol | CAS Registry Number: 144-11-6
Synonyms: Benzhexol, trihexyphenidyl, Triphenidyl, Trihexyphenidyle, Parkinane retard, Benzhexolum, Trihexifenidilo, Cyclodol, Artane, Trihexylphenidyl, Trihexylphenizyl, Trihexylphenidyle, Trihexyphenidylum, Sedrena (free base), Trihexyphenidyl HCl, Spectrum_000632, Trihexifenidilo [INN-Spanish], Trihexyphenidyl [INN:BAN], Trihexyphenidyl hydrochloride, Trihexyphenidyle [INN-French]

Molecular Formula: C20H31NOMolecular Weight: 301.466240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HWHLPVGTWGOCJO-UHFFFAOYSA-N

• ( S)-3-Amino-3-(2-thienyl)-propionic acid
IUPAC Name: (3S)-3-amino-3-thiophen-2-ylpropanoic acid | CAS Registry Number: 131829-50-0
Synonyms: (S)-3-Amino-3-(thiophen-2-yl)propanoic acid, (S)-3-amino-3-(2-thienyl)-propanoic acid, (S)-3-Amino-3-(2-thienyl)-propionic acid, 2-Thiophenepropanoicacid, b-amino-, (bS)-, AC1L3C5H, SureCN2481473, CTK4B7547, MolPort-003-794-806, ANW-73499, AKOS010394311, AB17799, AG-D-64626, H-D-GLY(2-THIENYL)-(C*CH2)OH, AK-57716, KB-05318, S-3-Amino-3-(2-thienyl)-propionic acid, BETA-(2-THIENYL)-D-BETA-HOMOGLYCINE, TL80073932, (3S)-3-amino-3-thiophen-2-ylpropanoic acid, (3S)-3-AMINO-3-(2-THIENYL)PROPANOIC ACID

Molecular Formula: C7H9NO2SMolecular Weight: 171.216860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GYAYLYLPTPXESE-YFKPBYRVSA-N


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