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Jiangsu Senxuan Pharmaceutical and Chemical Co., Ltd.

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Profile: Jiangsu Senxuan Pharmaceutical and Chemical Co., Ltd. is engaged in the production of pharmaceuticals, agrochemical intermediates and fine chemical products. We are an ISO 9001:2008 certified company. Our product line includes 1,4-dioxane, azelaic acid, diethyl ethylphenylmalonate, diethyl ethylmalonate, diethyl aminomalonate hydrochloride and ethyl phenylacetate. We are accredited with ISO 9001:2000 certification.

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• Agrochemicals
IUPAC Name: benzoic acid;(1'R,2S,4'R,6S,8'R,20'S,24'S)-2-butan-2-yl-21',24'-dihydroxy-12'-[(2R,5R)-4-methoxy-5-[4-methoxy-6-methyl-5-(methylamino)oxan-2-yl]oxy-6-methyloxan-2-yl]oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene]-2'-one

Molecular Formula: C56H81NO15Molecular Weight: 1008.256 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 16

InChIKey: GCKZANITAMOIAR-MFYGLRNKSA-N

• Azelaic Acid
IUPAC Name: nonanedioic acid | CAS Registry Number: 123-99-9
Synonyms: azelaic acid, NONANEDIOIC ACID, Lepargylic acid, Anchoic acid, Finacea, Azelex, Azelainsaeure, Nonandisaeure, Skinorem, Skinoren, Finevin, acide azelaique, Azelainic acid, acidum azelaicum, Azalaic Acid, Azleaic Acid, 1,9-Nonanedioic acid, n-Nonanedioic acid, Heptanedicarboxylic acid, 1tuf

Molecular Formula: C9H16O4Molecular Weight: 188.220940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BDJRBEYXGGNYIS-UHFFFAOYSA-N

• BDH Succinate Salt
IUPAC Name: butanedioic acid;tert-butyl N-[(2S,4S,5S)-5-amino-4-hydroxy-1,6-diphenylhexan-2-yl]carbamate | CAS Registry Number: 183388-64-9
Synonyms: BDH succinate salt, (2S,3S,5S)-5-tert-Butyloxycarbonylamino-2-amino-3-hydroxy-1,6-diphenylhexane succinate, AKOS015900386, RP17803, V0267, (2S,3S,5S)-5-tert-Butyloxycarbonylamino-2-amino-3-hydroxy-1, 6-diphenylhexane succinate

Molecular Formula: C50H70N4O10Molecular Weight: 887.111600 [g/mol]
H-Bond Donor: 8H-Bond Acceptor: 12

InChIKey: LAGICBLJBHDBSG-VVQWQMBKSA-N

• Benzobarbitone
IUPAC Name: 1-(benzoyl)-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione | CAS Registry Number: 744-80-9
Synonyms: Benzobarbital, Benzoylluminal, Benzoyluminal, Benzonalum, Benzonal, Benzoylphenobarbital, Benzobarbital [INN], Benzobarbitalum [INN-Latin], Oprea1_179037, C19H16N2O4, CID12938, BRN 0627140, 1-Benzoyl-5-ethyl-5-phenylbarbituric acid, 5-Ethyl-1-benzoyl-5-phenylbarbituric acid, NCGC00160414-01, LS-23803, N-Benzoyl-5-ethyl-5-phenylbarbituric acid, BARBITURIC ACID, 1-BENZOYL-5-ETHYL-5-PHENYL-, 5-24-09-00293 (Beilstein Handbook Reference), 1-Benzoyl-5-ethyl-5-phenyl-2,4,6-trioxohexahydropyrimidine

Molecular Formula: C19H16N2O4Molecular Weight: 336.341340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QMOWPJIFTHVQMB-UHFFFAOYSA-N

• Carbonic acid,4-nitrophenyl 5-thiazolylmethyl ester
IUPAC Name: (4-nitrophenyl) 1,3-thiazol-5-ylmethyl carbonate | CAS Registry Number: 144163-97-3
Synonyms: ((5-THIAZOLYL)METHYL)-(4-NITROPHENYL)CARBONATE, Thiazolylmethyl-4-nitrophenylcarbonate, Carbonic Acid,4-Nitrophenyl-5-thiazolyl methyl ester, SureCN272963, Jsp002588, CTK8B3900, ANW-43406, SBB063510, AKOS015889239, AC-1728, AM84400, QC-6295, RP17616, AK-33287, S030, 4-nitrophenyl thiazol-5-ylmethyl carbonate, FT-0650147, Carbonic acid 4-Nitrophenyl 5-thiazolylmethyl ester, Carbonic Acid 4-Nitrophenyl-5-thiazolylmethyl Ester, I01-1890

Molecular Formula: C11H8N2O5SMolecular Weight: 280.256620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: FTEKBGGQRNJIPQ-UHFFFAOYSA-N

• D-HPPA
IUPAC Name: (2R)-2-(4-hydroxyphenoxy)propanoic acid | CAS Registry Number: 94050-90-5
Synonyms: 474533_ALDRICH, TPC-I007, (R)-()-2-(4-Hydroxyphenoxy)propionic acid, (R)-(+)-2-(4-Hydroxyphenoxy) propionic acid

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: AQIHDXGKQHFBNW-ZCFIWIBFSA-N

• Dibenzosuberenone
Synonyms: Dibenzosuberone, 5-Dibenzosuberenone, 2,3:6,7-Dibenzotropone, 5H-Dibenzo[a,d]cyclohepten-5-one, 2,3:6,7-Dibenzosuberen-4-on-1, 5H-Dibenzo(a,d)cycloheptenone, Dibenzo(a,d)cyclohepten-5-one, Dibenzo(b,f)cyclohepten-1-one, D31737_ALDRICH, MLS001359822, WLN: L C676 BVJ, 5H-Dibenzo[a,d]cycloheptenone, Dibenzo[a,d]cyclohepten-5-one, 5H-Dibenzo(a,d)cyclohepten-5-one, EINECS 218-737-3, NSC 86151, AIDS211060, AIDS-211060, CID16679, NSC86151

Molecular Formula: C15H10OMolecular Weight: 206.239300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SNVTZAIYUGUKNI-UHFFFAOYSA-N

• Dibenzosuberone
Synonyms: Dibenzsuberone, Dibenzosuberan-5-one, Dibenzocycloheptenone, 5-Dibenzosuberone, 2,3:6,7-Dibenzosuberone, Dibenzocycloheptadienone, Dibenzo(b,f)cycloheptan-1-one, CCRIS 2780, D104981_ALDRICH, Dibenzo(a,d)cycloheptadien-5-one, EINECS 214-912-3, Dibenzo[a,d]cycloheptadien-5-one, NSC 49727, NSC49727, Dibenzo(a,d)cyclohepta(1,4)dien-5-one, 10,11-Dihydrodibenzo(a,d)cycloheptanone, 10,11-Dihydrodibenzo(a,d)cyclohepten-5-one, 10,11-Dihydrodibenzo[a,d]cycloheptanone, Dibenzo[a,d]cyclohepta[1,4]dien-5-one, LS-60829

Molecular Formula: C15H12OMolecular Weight: 208.255180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BMVWCPGVLSILMU-UHFFFAOYSA-N

• Diethyl 2-Amino Malonate Hydrochloride
IUPAC Name: diethyl 2-aminopropanedioate hydrochloride | CAS Registry Number: 13433-00-6
Synonyms: Diethyl aminomalonate hydrochloride, D87589_ALDRICH, DIETHYLAMINO MALONATE HCl, NSC76074, EINECS 236-556-8, CID3084143, TL806211, ST5308255, Aminomalonic acid diethyl ester hydrochloride, 6829-40-9

Molecular Formula: C7H14ClNO4Molecular Weight: 211.643360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: GLFVNTDRBTZJIY-UHFFFAOYSA-N

• Diethyl Diethylmalonate
IUPAC Name: diethyl 2,2-diethylpropanedioate | CAS Registry Number: 77-25-8
Synonyms: Diethyl diethylmalonate, Diethylmalonic ester, Ethyl diethylmalonate, Diethylmalonate diethyl ester, Diethyl 2,2-diethylmalonate, Diethylmalonic acid diethyl ester, Diethylmalonic acid, diethyl ester, 156817_ALDRICH, Diethyl 3,3-pentanedicarboxylate, NSC8710, NSC 8710, Propanedioic acid, diethyl-, diethyl ester, EINECS 201-016-2, ZINC01648195, Malonic acid, diethyl-, diethyl ester, AI3-05640, Malonic acid, diethyl-, diethyl ester (8CI), 3,3-PENTANEDICARBOXYLIC ACID,DIETHYL ESTER (DIETHYL MALONATE,DIETHYL ESTER), InChI=1/C11H20O4/c1-5-11(6-2,9(12)14-7-3)10(13)15-8-4/h5-8H2,1-4H

Molecular Formula: C11H20O4Molecular Weight: 216.274100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: ZKBBUZRGPULIRN-UHFFFAOYSA-N

• Diethyl Ethylmalonate
IUPAC Name: diethyl 2-ethylpropanedioate | CAS Registry Number: 133-13-1
Synonyms: DIETHYL ETHYLMALONATE, Diethyl 2-ethylmalonate, Diethyl ethylpropanedioate, Propanedioic acid, ethyl-, diethyl ester, D95204_ALDRICH, Malonic acid, ethyl-, diethyl ester, NSC8706, NSC 8706, EINECS 205-093-3, ZINC01648192, AI3-19481, Malonic acid, ethyl-, diethyl ester (8CI), 1,1-PROPANEDICARBOXYLIC ACID,DIETHYL ESTER (MALONIC ACID,ETHYL,DIETHYL ESTER), InChI=1/C9H16O4/c1-4-7(8(10)12-5-2)9(11)13-6-3/h7H,4-6H2,1-3H, 93264-17-6

Molecular Formula: C9H16O4Molecular Weight: 188.220940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: VQAZCUCWHIIFGE-UHFFFAOYSA-N

• Diethyl Phenyl Malonate
IUPAC Name: diethyl 2-phenylpropanedioate | CAS Registry Number: 83-13-6
Synonyms: Diethyl phenylmalonate, Diethyl 2-phenylmalonate, CBMicro_047868, Phenylmalonic acid diethyl ester, 111996_ALDRICH, Malonic acid, phenyl-, diethyl ester, Propanedioic acid, phenyl-, diethyl ester, NSC8126, NSC53560, EINECS 201-456-5, NSC 53560, TL806278, BIM-0047923.P001, AI3-07022, ST5308083, Malonic acid, phenyl-, diethyl ester (8CI), 5122-44-1, InChI=1/C13H16O4/c1-3-16-12(14)11(13(15)17-4-2)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H

Molecular Formula: C13H16O4Molecular Weight: 236.263740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: FGYDHYCFHBSNPE-UHFFFAOYSA-N

• Disodium Phenylmalonate
IUPAC Name: disodium;2-phenylpropanedioate | CAS Registry Number: 55277-85-5
Synonyms: Disodium 2-phenylpropanedioate, Disodium phenylmalonate, AC1MDA3G, AGN-PC-004CZI, SureCN9578977, Phenylmalonic Acid Disodium Salt, AKOS015890652, AC-20441, disodium;2-deuterio-2-phenylpropanedioate, FT-0655355, ST51052156, A830567, I01-7048

Molecular Formula: C9H6Na2O4Molecular Weight: 224.121079 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: TZRIUKNLJJXQMJ-UHFFFAOYSA-L

• ethyl 2-cyano-2-phenylbutanoate
IUPAC Name: ethyl 2-cyano-2-phenylbutanoate | CAS Registry Number: 718-71-8
Synonyms: NCIOpen2_003448, NSC69121, CID250114

Molecular Formula: C13H15NO2Molecular Weight: 217.263700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VCJAUIYSQAXNGB-UHFFFAOYSA-N

• Ethyl 2-Phenylbutyrate
IUPAC Name: ethyl 2-phenylbutanoate | CAS Registry Number: 119-43-7
Synonyms: Ethyl 2-phenylbutyrate, Ethyl 2-phenylbutanoate, Ethyl alpha-phenylbutyrate, Ethyl .alpha.-phenylbutyrate, 2-Phenylbutyric acid, ethyl ester, Butyric acid, 2-phenyl-, ethyl ester, NSC30680, EINECS 204-324-5, NSC 30680, Benzeneacetic acid, .alpha.-ethyl-, ethyl ester, AI3-05890, ST5443301, Benzeneacetic acid, alpha-ethyl-, ethyl ester, Butyric acid, 2-phenyl-, ethyl ester (8CI), 88197-27-7

Molecular Formula: C12H16O2Molecular Weight: 192.254240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CLLUFLLBRNCOLB-UHFFFAOYSA-N

• Ethyl Phenylacetate
IUPAC Name: ethyl 2-phenylacetate | CAS Registry Number: 101-97-3
Synonyms: Ethyl phenacetate, ETHYL PHENYLACETATE, Ethyl benzeneacetate, Ethyl phenylethanoate, Ethyl alpha-toluate, Ethyl 2-phenylethanoate, Benzeneacetic acid, ethyl ester, Ethyl .alpha.-toluate, Acetic acid, phenyl-, ethyl ester, nchembio.128-comp20a, Phenylacetic acid, ethyl ester, FEMA No. 2452, alpha-Toluic acid, ethyl ester, WLN: 2OV1R, Phenylacetic acid ethyl ester, W245208_ALDRICH, Phenyl-acetic acid ethyl ester, 108049_ALDRICH, 239445_ALDRICH, Phenyl-acetic acid, ethyl ester

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DULCUDSUACXJJC-UHFFFAOYSA-N

• Ethylphenylmalonic Acid Diethyl ester
IUPAC Name: diethyl 2-ethyl-2-phenylpropanedioate | CAS Registry Number: 76-67-5
Synonyms: Diethyl ethylphenylmalonate, Diethyl ethyl(phenyl)malonate, Diethyl 2-ethyl-2-phenylmalonate, 446416_ALDRICH, NSC5631, NSC 5631, EINECS 200-978-0, Ethylphenylmalonic acid diethyl ester, SBB008439, ZINC01687074, FR-2056, Propanedioic acid, ethylphenyl-, diethyl ester, Malonic acid, ethylphenyl-, diethyl ester, AI3-23846, Malonic acid, ethylphenyl-, diethyl ester (8CI), InChI=1/C15H20O4/c1-4-15(13(16)18-5-2,14(17)19-6-3)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H

Molecular Formula: C15H20O4Molecular Weight: 264.316900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: PKRVDBARWFJWEB-UHFFFAOYSA-N

• Fine Chemical Intermediates
• Isoamyl Phenylacetate
IUPAC Name: 3-methylbutyl 2-phenylacetate | CAS Registry Number: 102-19-2
Synonyms: Isoamyl phenylacetate, Isopentyl phenylacetate, Isopentylphenylacetate, Isoamyl alpha-toluate, 3-Methylbutyl phenylacetate, 3-Methylbutyl benzeneacetate, FEMA No. 2081, Phenylacetic acid, isopentyl ester, Benzeneacetic acid, 3-methylbutyl ester, WLN: 1Y12OV1R, EINECS 203-012-6, ACETIC ACID, PHENYL-, ISOPENTYL ESTER, NSC 60582, NSC60582, BRN 1951778, AI3-36555, LS-2842, InChI=1/C13H18O2/c1-11(2)8-9-15-13(14)10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H

Molecular Formula: C13H18O2Molecular Weight: 206.280820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QWBQBUWZZBUFHN-UHFFFAOYSA-N

• Methanol, Sodium Salt
IUPAC Name: sodium methanolate | CAS Registry Number: 124-41-4
Synonyms: Sodium methylate, Methoxysodium, Sodium methanolate, Feldalat NM, SODIUM METHOXIDE, Methanol, sodium salt, RNTqhDwHL@, Metilato sodico [Spanish], Sodium methoxide solution, Methylate de sodium [French], HSDB 755, EINECS 204-699-5, UN1289, UN1431, 156256_SIAL, 164992_SIAL, 403067_SIAL, AI3-52659, LS-91053, TL8000640

Molecular Formula: CH3NaOMolecular Weight: 54.023690 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: WQDUMFSSJAZKTM-UHFFFAOYSA-N

• Methyl 4-methylthiazole-5-carboxylate
IUPAC Name: methyl 4-methyl-1,3-thiazole-5-carboxylate | CAS Registry Number: 81569-44-0
Synonyms: Methyl 4-methyl-5-thiazolecarboxylate, methyl 4-methyl-1,3-thiazole-5-carboxylate, METHYL4-METHYLTHIAZOLE-5-CARBOXYLATE, ZINC00039512, PubChem9931, AC1LDWLB, SureCN255470, CTK4I8925, MolPort-002-887-000, ANW-50375, FC0895, AKOS005146043, AC-7645, AG-F-58283, CL 1163, MCULE-2693804512, methyl 4-methyl thiazole-5-carboxylate, RP22107, AK-27820, BR-27820

Molecular Formula: C6H7NO2SMolecular Weight: 157.190280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RRCLLMUIJYXSGZ-UHFFFAOYSA-N

• Methyl Phenylacetate
IUPAC Name: methyl 2-phenylacetate | CAS Registry Number: 101-41-7
Synonyms: METHYL PHENYLACETATE, Methyl benzeneacetate, Methyl alpha-toluate, Methyl 2-phenylacetate, Methyl phenylethanoate, Methyl benzeneethanoate, Benzeneacetic acid, methyl ester, Methyl .alpha.-toluate, nchembio.128-comp19a, Acetic acid, phenyl-, methyl ester, Phenylacetic acid, methyl ester, FEMA No. 2733, WLN: 1OV1R, W273309_ALDRICH, 108057_ALDRICH, Phenyl-acetic acid methyl ester, 78540_FLUKA, EINECS 202-940-9, NSC9405, NSC 401667

Molecular Formula: C9H10O2Molecular Weight: 150.174500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CRZQGDNQQAALAY-UHFFFAOYSA-N

• N-((n-Methyl-N-((2-Isopropyl-4-Thiazolyl)methyl)amino)carbonyl)-L-Valine
IUPAC Name: (2S)-3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoic acid | CAS Registry Number: 154212-61-0
Synonyms: N-[2-Isopropylthiazol-4-ylmethyl(methyl)carbamoyl]-L-valine, Ureidovaline, (S)-2-(3-((2-isopropylthiazol-4-yl)methyl)-3-methylureido)-3-methylbutanoic acid, PubChem13655, Ritonavir impurity A [EP], SureCN1389204, UNII-10433TZP2U, CTK4C8158, MolPort-005-932-660, ANW-46098, SBB066251, AKOS015896181, AC-4344, AG-E-02083, Ritonavir impurity, ureidovaline- [USP], AK-41437, S031, KB-258467, FT-0655838, I06-1589

Molecular Formula: C14H23N3O3SMolecular Weight: 313.415720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: OSQWRZICKAOBFA-NSHDSACASA-N

• N-[N-Methyl-N-((2-isopropyl-4-thiazolyl)methyl)aminocarbonyl]-L-valine lithium salt
IUPAC Name: lithium;3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoate | CAS Registry Number: 201409-23-6
Synonyms: N-(N-methyl-N-((2-isopropyl-4-thiazolyl)methyl)aminocarbonyl)-l-valine lithium salt, A814278, I14-0773, lithium 3-methyl-2-[[[methyl-[(2-propan-2-yl-4-thiazolyl)methyl]amino]-oxomethyl]amino]butanoate, lithium 3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoate

Molecular Formula: C14H22LiN3O3SMolecular Weight: 319.348780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: GXHCKLLMMZHJOG-UHFFFAOYSA-M

• N-Benzyl-4-Hydroxy Piperidine
IUPAC Name: 1-(phenylmethyl)piperidin-4-ol | CAS Registry Number: 4727-72-4
Synonyms: 1-Benzyl-4-piperidinol, 1-Benzyl-4-hydroxypiperidine, 1-Benzylpiperidin-4-ol, Maybridge4_002103, N-Benzyl-4-hydroxypiperidine, Oprea1_200507, 152986_ALDRICH, 4-Piperidinol, 1-(phenylmethyl)-, NSC72991, CID78461, EINECS 225-226-9, NCGC00176919-01, ST5308483, TL8003220, SR-01000633765-1

Molecular Formula: C12H17NOMolecular Weight: 191.269480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BPPZXJZYCOETDA-UHFFFAOYSA-N

• N-Benzyl-4-Piperidone
IUPAC Name: 1-(phenylmethyl)piperidin-4-one | CAS Registry Number: 3612-20-2
Synonyms: 1-Benzyl-4-piperidone, 1-Benzylpiperidone, 1-Benzyl-4-oxopiperidine, N-Benzylpiperidinone, N-Benzyl-4-piperidone, 1-benzylpiperidin-4-one, N-Benzyl-4-piperidinone, N-Benzylpiperidin-4-one, 1-Benzyl-4-piperidinone, 4-Piperidone, 1-benzyl-, 4-Piperidinone, 1-(phenylmethyl)-, NCIOpen2_000865, B29806_ALDRICH, 4-PIPERIDONE,1-BENZYL, NSC77933, EINECS 222-782-4, ST5406349, TL8002672, EU-0099975, T-000015

Molecular Formula: C12H15NOMolecular Weight: 189.253600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SJZKULRDWHPHGG-UHFFFAOYSA-N

• N-boc-4-Piperidinol
IUPAC Name: tert-butyl 4-hydroxypiperidine-1-carboxylate | CAS Registry Number: 109384-19-2
Synonyms: 1-Boc-4-piperidinol, 1-Boc-4-hydroxypiperidine, Maybridge3_000273, N-Boc-4-hydroxy-piperidine, 495484_ALDRICH, ARONIS010264, 50408_FLUKA, ZINC00066271, IDI1_011660, ST5307498, TL8000300, tert-Butyl 4-hydroxy-1-piperidinecarboxylate, tert-butyl 4-hydroxypiperidine-1-carboxylate, 1-piperidinecarboxylic acid, 4-hydroxy-, 1,1-dimethylethyl ester, InChI=1/C10H19NO3/c1-10(2,3)14-9(13)11-6-4-8(12)5-7-11/h8,12H,4-7H2,1-3H

Molecular Formula: C10H19NO3Molecular Weight: 201.262760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PWQLFIKTGRINFF-UHFFFAOYSA-N

• P-Chlorophenylacetic Acid
IUPAC Name: 2-(4-chlorophenyl)acetic acid | CAS Registry Number: 1878-66-6
Synonyms: 4-Chlorophenylacetic acid, (4-Chlorophenyl)acetic acid, 4-Chlorobenzeneacetic acid, (p-Chlorophenyl)acetic acid, Benzeneacetic acid, 4-chloro-, Acetic acid, (p-chlorophenyl)-, 4-Chlorophenyl acetate, P-CHLOROPHENYLACETIC ACID, 2-(p-Chlorophenyl)acetic acid, 4-Chlorophenyl acetic acid, 4-CHLOROPHENYLACETATE, (p-Chloro-phenyl)acetic acid, 139262_ALDRICH, CHEBI:30749, EINECS 217-521-6, NSC 14285, AIDS017634, AIDS-017634, NSC14285, BRN 1072816

Molecular Formula: C8H7ClO2Molecular Weight: 170.592980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CDPKJZJVTHSESZ-UHFFFAOYSA-N

• Pharmaceuticals
IUPAC Name: 2-[2-[bis(2-oxido-2-oxoethyl)amino]ethyl-(2-oxido-2-oxoethyl)azaniumyl]acetate

Molecular Formula: C10H13N2O8-3Molecular Weight: 289.218820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: KCXVZYZYPLLWCC-UHFFFAOYSA-K

• Phenethyl Phenylacetate
IUPAC Name: 2-phenylethyl 2-phenylacetate | CAS Registry Number: 102-20-5
Synonyms: Phenethyl phenylacetate, Phenylethyl phenylacetate, 2-Phenylethyl phenylacetate, Phenethyl alpha-toluate, Benzylcarbinyl phenylacetate, Benzylcarbinyl alpha-toluate, 2-Phenylethyl alpha-toluate, 2-Phenylethyl benzeneacetate, Phenethyl .alpha.-toluate, 1-Phenylethyl phenylacetate, FEMA No. 2866, WLN: R2OV1R, Benzyl carbinyl phenylacetate, Phenylacetic acid, phenethyl ester, Benzeneacetic acid, 2-phenylethyl ester, beta-Phenylethyl phenylacetate, W286605_ALDRICH, Benzylcarbinyl .alpha.-toluate, 2-Phenylethyl .alpha.-toluate, .beta.-Phenylethyl phenylacetate

Molecular Formula: C16H16O2Molecular Weight: 240.297040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZOZIRNMDEZKZHM-UHFFFAOYSA-N

• Phenylmalonic Acid
IUPAC Name: 2-phenylpropanedioic acid | CAS Registry Number: 2613-89-0
Synonyms: Phenylmalonic acid, 2-Phenylmalonic acid, Malonic acid, phenyl-, Propanedioic acid, phenyl-, Ambap2995, 1o4p, 2-phenylpropanedioic acid, PHENYL MALONIC ACID, alpha-Carboxyphenylacetic acid, 160369_ALDRICH, Malonic acid, phenyl- (8CI), .alpha.-Carboxyphenylacetic acid, RU78191, CID75791, NSC27164, NSC41697, EINECS 220-044-6, NSC 27164, NSC 41697, Toluene-alpha,alpha-dicarboxylic acid

Molecular Formula: C9H8O4Molecular Weight: 180.157420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: WWYDYZMNFQIYPT-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-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

• 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-4-Phenyl-2-oxazolidinone
IUPAC Name: (4S)-4-phenyl-1,3-oxazolidin-2-one | CAS Registry Number: 99395-88-7
Synonyms: 376698_ALDRICH, 78875_FLUKA, (S)-()-4-Phenyl-2-oxazolidinone, ZINC00143123, (S)-(+)-4-Phenyl-2-oxazolidinone, TL8006065, A00133, InChI=1/C9H9NO2/c11-9-10-8(6-12-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,11

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

InChIKey: QDMNNMIOWVJVLY-MRVPVSSYSA-N

• Sodium Ethoxide
IUPAC Name: sodium ethanolate | CAS Registry Number: 141-52-6
Synonyms: Sodium ethoxide, Sodium ethylate, Ethoxysodium, Caustic alcohol, Ethanol, sodium salt, SODIUM ETHANOLATE, Sodium ethoxide solution, Ethyl alcohol, sodium salt, SODIUM ETHYLATE, POWDER, 156248_ALDRICH, 230553_ALDRICH, 71210_FLUKA, HSDB 5637, EINECS 205-487-5, AI3-52660, 24448-24-6

Molecular Formula: C2H5NaOMolecular Weight: 68.050270 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QDRKDTQENPPHOJ-UHFFFAOYSA-N

• Z-Lys(Boc)-OH
IUPAC Name: (4S)-4-(phenylmethyl)-1,3-oxazolidin-2-one | CAS Registry Number: 90719-32-7
Synonyms: (S)-4-Benzyl-2-oxazolidinone, 294640_ALDRICH, 13616_FLUKA, CID736225, ZINC00156419, ZINC04284392, SB 02020, TL8005821, InChI=1/C10H11NO2/c12-10-11-9(7-13-10)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12

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

InChIKey: OJOFMLDBXPDXLQ-VIFPVBQESA-N

• (4R,5S)-4-Methyl-5-phenyl-2-oxazolidinone
IUPAC Name: 4-methyl-5-phenyl-1,3-oxazolidin-2-one | CAS Registry Number: 77943-39-6
Synonyms: Meph-2-oxazolidinone, NCIOpen2_000611, CBiol_000537, 4-Methyl-5-phenyl-1,3-oxazolidin-2-one, NSC69199, CID250174, ICCB3_000185, ZINC00389617, 2-Oxazolidinone, 4-methyl-5-phenyl-, Oxazolid-2-one, 4-methyl-5-phenyl-, 2-Oxazolidinone, 4-methyl-5-phenyl-, cis-, (4R,5S)-(+)-4-Methyl-5-phenyl-2-oxazolidinone, 4-Methyl-5-phenyl-2-oxazolidinone (4R-cis)-, 2-Oxazolidinone, 4-methyl-5-phenyl-, (4R-cis)-, 54418-69-8

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

InChIKey: PPIBJOQGAJBQDF-UHFFFAOYSA-N

• (4S,5R)-4-Methyl-5-phenyl-2-oxazolidinone
IUPAC Name: (4S,5R)-4-methyl-5-phenyl-1,3-oxazolidin-2-one | CAS Registry Number: 16251-45-9
Synonyms: 340529_ALDRICH, CID853161, ZINC00389615, ZINC00389617, (4S,5R)-(−)-4-Methyl-5-phenyl-2-oxazolidinone

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

InChIKey: PPIBJOQGAJBQDF-CBAPKCEASA-N

• (4R,5R)-4-Methyl-5-phenyl-2-oxazolidinone
IUPAC Name: (4R,5R)-4-methyl-5-phenyl-1,3-oxazolidin-2-one | CAS Registry Number: 125133-96-2
Synonyms: (4R,5R)-4-METHYL-5-PHENYL-2-OXAZOLIDINONE, AC1O73LC, SureCN6374631, CTK4B4256, ZINC00155919, AKOS006306336, AG-D-53208, (4R,5R)-4-methyl-5-phenyl-1,3-oxazolidin-2-one

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

InChIKey: PPIBJOQGAJBQDF-APPZFPTMSA-N

• (4S,5S)-4-Methyl-5-phenyl-2-oxazolidinone
IUPAC Name: (4S,5S)-4-methyl-5-phenyl-1,3-oxazolidin-2-one | CAS Registry Number: 17097-67-5
Synonyms: SureCN5544656, CTK4D3781, ZINC00389616, AG-E-20293, 2-Oxazolidinone,4-methyl-5-phenyl-, (4S,5S)-, (4S,5S)-4-methyl-5-phenyl-1,3-oxazolidin-2-one, (4S,5R)-(-)-4-Methyl-2-oxo-5-phenyl-1,3-oxazolidine, 2-Oxazolidinone,4-methyl-5-phenyl-, (4S,5S)-(+)- (8CI); 2-Oxazolidinone, 4-methyl-5-phenyl-,(4S-trans)-; (4S,5S)-4-Methyl-5-phenyl-2-oxazolidinone;(4S,5S)-4-Methyl-5-phenyl-2-oxazolidinone

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

InChIKey: PPIBJOQGAJBQDF-IONNQARKSA-N

• 4-Methoxyphenylacetone
IUPAC Name: 1-(4-methoxyphenyl)propan-2-one | CAS Registry Number: 122-84-9
Synonyms: Anisketone, p-Acetonylanisole, p-Anisylactone, Anisic ketone, Anisalacetone, Anisolacetone, Anisyl methyl ketone, p-Methoxyphenylacetone, 4-Methoxybenzyl methyl ketone, p-Methoxybenzyl methyl ketone, 2-Propanone, 1-(4-methoxyphenyl)-, 1-(4-Methoxyphenyl)acetone, 1-(p-Anisyl)-2-propanone, 1-(p-Methoxyphenyl)-2-propanone, 4'-Methoxyphenyl-2-propanone, (p-Methoxyphenyl)-2-propanone, FEMA No. 2674, 1-(4-Methoxyphenyl)-2-propanone, ghl.PD_Mitscher_leg0.658, W267406_ALDRICH

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WFWKNGZODAOLEO-UHFFFAOYSA-N

• 4-Chloro Phenyl Ethanol
IUPAC Name: 2-(4-chlorophenyl)ethanol | CAS Registry Number: 1875-88-3
Synonyms: Benzeneethanol, 4-chloro-, Ambap5876, 4-Chlorophenethyl alcohol, p-Chlorophenethylic alcohol, 4-Chlorophenyl methyl carbinol, 2-(4-Chlorophenyl)ethanol, 183423_ALDRICH, p-CHLOROPHENYLMETHYCARBINOL, EINECS 217-506-4, NSC404206, ZINC00160799, 4-(2-HYDROXYETHYL)-CHLORBENZOL, AI3-02719, InChI=1/C8H9ClO/c9-8-3-1-7(2-4-8)5-6-10/h1-4,10H,5-6H, 3391-10-4

Molecular Formula: C8H9ClOMolecular Weight: 156.609460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HZFRKZWBVUJYDA-UHFFFAOYSA-N

• 4-Methyl-5-Hydroxyethyl Thiazole
IUPAC Name: 2-(4-methyl-1,3-thiazol-5-yl)ethanol | CAS Registry Number: 137-00-8
Synonyms: Hemineurine, sulfurol, Thiamine thiazole, 5-Thiazoleethanol, 4-methyl-, 4-Methyl-5-thiazolethanol, 4-Methyl-5-hydroxyethylthiazole, 4-METHYL-5-THIAZOLEETHANOL, 5-(2-Hydroxyethyl)-4-methylthiazole, MHT (VAN), 4-Methyl-5-thiazolylethanol, W320404_ALDRICH, 4-Methyl-5-hydroxethylthiazole, FEMA No. 3204, 190675_ALDRICH, 2-(4-Methylthiazol-5-yl)ethanol, 4-methyl-5-(2-hydroxyethyl)-thiazole, NChemBio.2007.13-comp11, CHEBI:17957, CID1136, 4-Methyl-5-(2-hydroxyethyl)thiazole

Molecular Formula: C6H9NOSMolecular Weight: 143.206760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BKAWJIRCKVUVED-UHFFFAOYSA-N

• 4-methyl-5-thiazolecarboxylic acid ethylester
IUPAC Name: ethyl 4-methyl-1,3-thiazole-5-carboxylate | CAS Registry Number: 20582-55-2
Synonyms: NSC170824, CID298610, ZINC00368976, BAS 00125252, 4-Methyl-thiazole-5-carboxylic acid ethyl ester, 5-Thiazolecarboxylic acid, 4-methyl-, ethyl ester, Thiazole-5-carboxylic acid, 4-methyl-, ethyl ester

Molecular Formula: C7H9NO2SMolecular Weight: 171.216860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WISQBJLUORKXNY-UHFFFAOYSA-N

• 2-Acetyltoluene
IUPAC Name: 1-(2-methylphenyl)ethanone | CAS Registry Number: 577-16-2
Synonyms: o-Acetyltoluene, o-Methylacetophenone, 2-Methylacetophenone, 2'-Methylacetylphenone, o-Methyl acetophenone, Acetophenone, 2'-methyl-, Methyl o-tolyl ketone, 2'-METHYLACETOPHENONE, METHYLACETOPHENONE, Ethanone, 1-(2-methylphenyl)-, 1-(2-Methylphenyl)ethanone, M26593_ALDRICH, 1-(Methylphenyl)ethan-1-one, Ethanone, 1-(methylphenyl)-, 65460_FLUKA, Acetophenone, 2'-methyl- (8CI), NSC84233, EINECS 209-408-5, EINECS 247-691-7, NSC 84233

Molecular Formula: C9H10OMolecular Weight: 134.175100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YXWWHNCQZBVZPV-UHFFFAOYSA-N

• 5-Hydroxymethyl Thiazole
IUPAC Name: 1,3-thiazol-5-ylmethanol | CAS Registry Number: 38585-74-9
Synonyms: 5-Thiazolemethanol, 5-Hydroxymethylthiazole, Ambap2763, ZINC02527712, CID2763216, T2166M500, TL8002812

Molecular Formula: C4H5NOSMolecular Weight: 115.153600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WKBQQWDVVHGWDB-UHFFFAOYSA-N

• 1,3-Dioxolane
IUPAC Name: 1,3-dioxolane | CAS Registry Number: 646-06-0
Synonyms: Glycolformal, Formal glycol, Glycol formal, 1,3-DIOXOLANE, Dioxolan [Czech], 1,3-Dioxolan, 1,3-Dioxacyclopentane, DIOXOLANE, Ethylene glycol formal, Glycol methylene ether, Ethylene glycol, formal, 1,3-Dioxole, dihydro-, Formaldehyde ethylene acetal, CCRIS 4912, HSDB 5737, Ethylene glycol methylene ether, 184497_ALDRICH, 271020_ALDRICH, EINECS 211-463-5, UN1166

Molecular Formula: C3H6O2Molecular Weight: 74.078540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WNXJIVFYUVYPPR-UHFFFAOYSA-N

• 1,4-Dioxane
IUPAC Name: 1,4-dioxane | CAS Registry Number: 123-91-1
Synonyms: p-Dioxane, Dioxane, Dioxan, Diethylene ether, 1,4-DIOXANE, Diethylene oxide, Diokan, Di(ethylene oxide), Tetrahydro-p-dioxin, Diethylene dioxide, para-Dioxane, Dioxyethylene ether, 1,4-Diethylene dioxide, Dioxane-1,4, Dioxanne, Glycolethylenether, Dioksan, Glycol ethylene ether, Diox, :dioxane

Molecular Formula: C4H8O2Molecular Weight: 88.105120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RYHBNJHYFVUHQT-UHFFFAOYSA-N

• 4-Methyl Thiazol
IUPAC Name: 4-methyl-1,3-thiazole | CAS Registry Number: 693-95-8
Synonyms: 4-METHYLTHIAZOLE, Thiazole, 4-methyl-, 4-Methyl-1,3-thiazole, FEMA No. 3716, HSDB 5747, MLS002152888, W371602_ALDRICH, 193925_ALDRICH, CHEBI:35626, EINECS 211-764-1, NSC 42976, NSC42976, BRN 0105228, ZINC01675771, LS-2170, NCGC00091734-01, SMR001224500, TL8004861, PB256786162, 4-27-00-00969 (Beilstein Handbook Reference)

Molecular Formula: C4H5NSMolecular Weight: 99.154200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QMHIMXFNBOYPND-UHFFFAOYSA-N


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