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APAC Pharmaceutical, LLC

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Contact: Andy Yao
Web: http://www.apacpharma.com
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Address: 6851 Oak Hall Lane, Suite 101, Columbia, Maryland 21045, USA
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Profile: APAC Pharmaceutical, LLC is a custom chemical and cGMP manufacturing company. We provide chemistry & manufacturing solutions for specialty chemical, pharmaceutical and bio-tech companies. Our specialty product lines are specialty intermediates, metabolites, research reference standards, and drug like compound libraries. These products represent highly characterized compounds of drug substances, impurities, degradation products, metabolites and performance calibrators. Our products include fondaparinux sodium, 2,3,0-(3-pentylidene)-d-gluceraldhyde, 4, 4 -difluoro-cyclohexane carboxylic acid, 1,3,5-tris[(3,3,3-trifluoropropyl)methyl]cyclotrisiloxane, (s)-(-)-4-benzyl-2-oxazolidinone, d-(-)-2-aminobutylic acid, and (r)-tert-butanesulfinamide. We are also specialized in the research and production of synthetic peptides. We develop and manufacture custom peptides & custom cGMP peptides. We have a wide range of modified peptides such as those with unnatural amino acid, phosphorylation, terminal modifications and cyclization. We specialize in the modification of nucleosides and nucleotides. We offer a variety of modified and non-modified nucleoside/nucleotide as well as their analogs. We manufacture a variety of aromatic and unsaturated N, O, S heterocyclic ring including heteroaromatic synthons, complex heterocyclic systems & novel heteroaromatic compounds.

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• 2-Pyrimidinamine, 4-(3-pyridinyl)-
IUPAC Name: 4-pyridin-3-ylpyrimidin-2-amine | CAS Registry Number: 66521-66-2
Synonyms: 4-(pyridin-3-yl)pyrimidin-2-amine, 4-(3-Pyridinyl)-2-aminopyrimidine, 2-Amino-4-(3-pyridinyl)-pyrimidine, 4-(3-Pyridinyl)-2-pyrimidine amine, CHEMBL1236798, 4-(3-Pyridinyl)-2-pyrimidinamine, 4-(3-pyridyl)pyrimidine-2-ylamine, AG-G-51048, 4-(PYRIDIN-3-YL)-2-PYRIMIDINE AMINE, 2xdk, SureCN210431, CTK5C4848, 4-(3-Pyridyl)-2-pyrimidinamine, MolPort-002-344-109, BB_SC-5653, AMX10176, 2-Amino-4-(3-pyridinyl)pyrimidine, 2-Pyrimidinamine,4-(3-pyridinyl)-, ANW-44611, SBB070175

Molecular Formula: C9H8N4Molecular Weight: 172.186620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: LQHQKYWYKPLKCH-UHFFFAOYSA-N

• 2H-Isoindole-2-propanoic acid, a-acetyl-1,3-dihydro-1,3-dioxo-, ethyl ester
IUPAC Name: ethyl 2-[(1,3-dioxoisoindol-2-yl)methyl]-3-oxobutanoate | CAS Registry Number: 16880-35-6
Synonyms: SCHEMBL5998387, AKOS015960540, HE058516, ETHYL 2-(N- PHTHALIMIDOMETHYL)-3-OXOBUTYRATE, 2-(1,3-Dioxo-2H-isoindole-2-ylmethyl)-3-oxobutanoic acid ethyl ester, A-acetyl-1,3-dihydro-1,3-dioxo-2H-isoindole-2-propanoic acid ethyl ester

Molecular Formula: C15H15NO5Molecular Weight: 289.287 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: ADRZKSCWMUVSDY-UHFFFAOYSA-N

• 3 - Acetyl-2-Amino Pyridine
IUPAC Name: 1-(2-aminopyridin-3-yl)ethanone | CAS Registry Number: 65326-33-2
Synonyms: 2-AMINO-3-ACETYLPYRIDINE, 1-(2-aminopyridin-3-yl)ethanone, 3-Acetyl-2-aminopyridine, 1-(2-aminopyridin-3-yl)ethan-1-one, SBB065617, AG-G-45836, aminopyridinylethanone, PubChem18534, 2-Amino-3-Acetyl pyridine, SureCN1322157, 3-ACETYLPYRIDIN-2-AMINE, CTK5C2559, MolPort-001-758-288, ACT07685, ANW-74324, ZINC19851162, Ethanone,1-(2-amino-3-pyridinyl)-, AKOS005072803, 1-(2-Amino-3-pyridinyl)-1-ethanone, AB11689

Molecular Formula: C7H8N2OMolecular Weight: 136.151220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BNVLGAQNNFJKHG-UHFFFAOYSA-N

• 3,3'-Dihydroxy diphenyl disulfide
IUPAC Name: 3-[(3-hydroxyphenyl)disulfanyl]phenol | CAS Registry Number: 21101-56-4
Synonyms: Bis(3-hydroxyphenyl) Disulfide, 3,3'-Dihydroxydiphenyl disulfide, 3-[(3-hydroxyphenyl)disulfanyl]phenol, 3,3'-Dithiodiphenol, ACMC-209fhl, AC1MC4YI, Phenol, 3,3'-dithiobis-, 549312_ALDRICH, Jsp004320, 3,3'-Dihydroxydiphenyldisulphide, CTK1A1383, MolPort-001-768-641, ANW-24343, OR4665, ZINC02243468, AKOS015898662, AG-E-54843, RP28906, AC-11521, L403

Molecular Formula: C12H10O2S2Molecular Weight: 250.336600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XBNOMKROXZGMFW-UHFFFAOYSA-N

• 3,3'-Diindolylmethane
IUPAC Name: 3-(1H-indol-3-ylmethyl)-1H-indole | CAS Registry Number: 1968-05-4
Synonyms: 3,3'-Diindolymethane, 3,3,-diindolylmethane, 3,3'-Methylenebis-1H-indole, Spectrum2_001711, Spectrum3_001989, Spectrum5_001955, bis-1H-indol-3-ylmethane, CCRIS 5806, CBiol_001839, Oprea1_472633, Oprea1_740951, 3,3'-methylenebis(1H-indole), BSPBio_001290, BSPBio_003589, CBDivE_010856, KBioGR_000010, KBioSS_000010, SPECTRUM1505331, SPBio_001722, 1H-Indole, 3,3'-methylenebis-

Molecular Formula: C17H14N2Molecular Weight: 246.306460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VFTRKSBEFQDZKX-UHFFFAOYSA-N

• 3,4,5-Trichlorobenzotrifluoride
IUPAC Name: 1,2,3-trichloro-5-(trifluoromethyl)benzene | CAS Registry Number: 50594-82-6
Synonyms: EINECS 256-636-6, T109, ST5405198, 1,2,3-Trichloro-5-(trifluoromethyl)benzene, InChI=1/C7H2Cl3F3/c8-4-1-3(7(11,12)13)2-5(9)6(4)10/h1-2

Molecular Formula: C7H2Cl3F3Molecular Weight: 249.444990 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: FBKFIAIRSQOXJR-UHFFFAOYSA-N

• 3,4,5-Trifluorophenol
IUPAC Name: 3,4,5-trifluorophenol | CAS Registry Number: 99627-05-1
Synonyms: Ambap7730, 51092_FLUKA, 65987_FLUKA, ZINC02584330, JRD-0229, CID2777943, TL8006074

Molecular Formula: C6H3F3OMolecular Weight: 148.082630 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZRTWIJKGTUGZJY-UHFFFAOYSA-N

• 3,4,5-Trimethoxybenzaldehyde
IUPAC Name: 3,4,5-trimethoxybenzaldehyde | CAS Registry Number: 86-81-7
Synonyms: 3,4,5-TRIMETHOXYBENZALDEHYDE, Benzaldehyde, 3,4,5-trimethoxy-, T68403_ALDRICH, 92140_FLUKA, EINECS 201-701-6, BENZALDEHYDE,3,4,5-TRIMETHOXY-, NSC 16692, AIDS017928, AIDS-017928, NSC16692, BRN 0395163, SBB016338, ZINC02504375, AI3-36673, LS-25170, TL8005630, 4-08-00-02719 (Beilstein Handbook Reference), InChI=1/C10H12O4/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-6H,1-3H

Molecular Formula: C10H12O4Molecular Weight: 196.199880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OPHQOIGEOHXOGX-UHFFFAOYSA-N

• 3,4,5-Trimethoxybenzoic acid
IUPAC Name: 3,4,5-trimethoxybenzoic acid | CAS Registry Number: 118-41-2
Synonyms: Eudesmic acid, Trimethylgallic acid, Gallic acid trimethyl ether, Tri-O-methylgallic acid, Spectrum_000082, SpecPlus_000919, Veratric acid, 5-methoxy-, Spectrum2_000791, Spectrum3_000260, Spectrum4_001625, Spectrum5_000409, 3,4,5-TRIMETHOXYBENZOIC ACID, Benzoic acid, 3,4,5-trimethoxy-, Oprea1_180796, BSPBio_001680, CBDivE_013176, CBDivE_014084, KBioGR_002029, KBioSS_000502, T69000_ALDRICH

Molecular Formula: C10H12O5Molecular Weight: 212.199280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: SJSOFNCYXJUNBT-UHFFFAOYSA-N

• 3,4-DiaminoAnisole
IUPAC Name: 4-methoxybenzene-1,2-diamine | CAS Registry Number: 102-51-2
Synonyms: 3,4-Diaminoanisole, 4-Methoxy-o-phenylenediamine, 4-Methoxy-1,2-benzenediamine, 4-Methoxy-1,2-diaminobenzene, NCIOpen2_003403, o-Phenylenediamine, 4-methoxy-, 2-amino-4-methoxyphenylamine, 1,2-Benzenediamine, 4-methoxy-, ALBB-006147, NSC62971, BRN 0878789, CID153404, ZINC00152529, 1,2-Benzenediamine, 4-methoxy- (9CI), LS-105867, 4-13-00-01448 (Beilstein Handbook Reference)

Molecular Formula: C7H10N2OMolecular Weight: 138.167100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AGAHETWGCFCMDK-UHFFFAOYSA-N

• 3,4-Dichloro-2-nitro-6-(trifluoromethyl)toluene
IUPAC Name: 1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)benzene | CAS Registry Number: 115571-66-9
Synonyms: 3,4-dichloro-2-nitro-6-(trifluoromethyl)toluene, 1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)benzene, SBB063831, 3,4-Dichloro-6-trifluoromethyl-2-nitrotoluene, Benzene, 1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)-, Benzene,1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)-, PubChem4542, ACMC-1BSWN, AC1MY7MN, KSC509G8F, CTK4A9382, MolPort-001-772-766, ANW-51570, ZINC02540239, AKOS005762908, AG-D-36642, AC-11249, AK-46544, BR-46544, KB-70090

Molecular Formula: C8H4Cl2F3NO2Molecular Weight: 274.024070 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: IBRWCYHTODRXJR-UHFFFAOYSA-N

• 3,4-Dichloroaniline
IUPAC Name: 3,4-dichloroaniline | CAS Registry Number: 95-76-1
Synonyms: 3,4-DICHLOROANILINE, 3,4-Dichloranilin, 4,5-Dichloroaniline, 3,4-Dichloraniline, 3,4-Dichlorobenzenamine, Benzenamine, 3,4-dichloro-, m.p-Dichloroaniline, Aniline, 3,4-dichloro-, m,p-dichloroaniline, 3,4-Dichlorophenylamine, 1-Amino-3,4-dichlorobenzene, 3,4-DCA, DCA (VAN), WLN: ZR CG DG, 34-DICHLOROANILINE, 4-Amino-1,2-dichlorobenzene, CCRIS 2395, nchembio.2007.32-comp5, HSDB 1319, MLS002152880

Molecular Formula: C6H5Cl2NMolecular Weight: 162.016600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SDYWXFYBZPNOFX-UHFFFAOYSA-N

• 3,4-Dichlorobenzyl Chloride
IUPAC Name: 1,2-dichloro-4-(chloromethyl)benzene | CAS Registry Number: 102-47-6
Synonyms: 3,4-Dichlorobenzyl chloride, alpha,3,4-Trichlorotoluene, Toluene, .alpha.,3,4-trichloro-, .alpha.,3,4-Trichlorotoluene, 259179_ALDRICH, 35510_FLUKA, Benzene, 1,2-dichloro-4-(chloromethyl)-, 3,4-Dichlorophenylmethyl chloride, EINECS 203-033-0, NSC406893, NSC 406893, Toluene, alpha,3,4-trichloro- (8CI), 1,2-DICHLORO-4-(CHLOROMETHYL)BENZENE, AI3-14887, ST5214094, TL8000123, InChI=1/C7H5Cl3/c8-4-5-1-2-6(9)7(10)3-5/h1-3H,4H

Molecular Formula: C7H5Cl3Molecular Weight: 195.473600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: YZIFVWOCPGPNHB-UHFFFAOYSA-N

• 3,4-Dichlorophenylacetonitrile
IUPAC Name: 2-(3,4-dichlorophenyl)acetonitrile | CAS Registry Number: 3218-49-3
Synonyms: 3,4-Dichlorobenzyl cyanide, 232475_ALDRICH, 35530_FLUKA, (3,4-Dichlorophenyl)acetonitrile, Benzeneacetonitrile, 3,4-dichloro-, EINECS 221-743-9, NSC111725, ZINC00164770, FS000811, AI3-12074, ST5406497, TL8002447, InChI=1/C8H5Cl2N/c9-7-2-1-6(3-4-11)5-8(7)10/h1-2,5H,3H

Molecular Formula: C8H5Cl2NMolecular Weight: 186.038000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QWZNCAFWRZZJMA-UHFFFAOYSA-N

• 3,4-Difluorobenzoic Acid
IUPAC Name: 3,4-difluorobenzoic acid | CAS Registry Number: 455-86-7
Synonyms: 3,4-Difluorobenzoic acid, Benzoic acid, 3,4-difluoro-, 264318_ALDRICH, NSC190686, CID99166, JRD-0041, EINECS 207-249-6, SBB006721, TL8003167, InChI=1/C7H4F2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H,10,11

Molecular Formula: C7H4F2O2Molecular Weight: 158.102266 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: FPENCTDAQQQKNY-UHFFFAOYSA-N

• 3,4-Dimethoxy-L-phenylalanine
IUPAC Name: (2S)-2-amino-3-(3,4-dimethoxyphenyl)propanoic acid | CAS Registry Number: 32161-30-1
Synonyms: L-3,4-Dimethoxyphenyl alanine, (S)-2-Amino-3-(3,4-dimethoxyphenyl)propionic acid, L-Tyrosine,3-methoxy-O-methyl-, 3-(3,4-Dimethoxyphenyl)-L-alanine, (S)-2-Amino-3-(3,4-Dimethoxy-Phenyl)-Propionic Acid, PubChem13434, SureCN159001, AC1Q49KI, 472727_ALDRICH, CTK4G8319, MolPort-001-793-080, ACN-S002401, ACT00014, ANW-74966, (S)-b-(3,4-dimethoxyphenyl)alanine, AKOS007930123, AKOS010367899, AG-F-07419, RL03145, AK-41629

Molecular Formula: C11H15NO4Molecular Weight: 225.241100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: VWTFNYVAFGYEKI-QMMMGPOBSA-N

• 3,4-Dimethoxyphenethylamine
IUPAC Name: 2-(3,4-dimethoxyphenyl)ethanamine | CAS Registry Number: 120-20-7
Synonyms: Homoveratrylamine, Dimethoxydopamine, Dimethylmescaline, DIMPEA, DMPEA, Dimethoxyphenylethylamine, 3,4-Dimethoxydopamine, Dopamine dimethyl ether, O,O-Dimethyldopamine, DMPE, 3,4-Dimethoxyphenylethylamine, 3,4-Di-O-methyldopamine, Benzeneethanamine, 3,4-dimethoxy-, 3,4-Dimethoxybenzeneethanamine, 2-(3,4-Dimethoxyphenyl)ethylamine, NCIOpen2_005995, Oprea1_397610, PHENETHYLAMINE, 3,4-DIMETHOXY-, MLS000515889, 3,4-Dimethoxyphenylethylamine(base)

Molecular Formula: C10H15NO2Molecular Weight: 181.231600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ANOUKFYBOAKOIR-UHFFFAOYSA-N

• 3,4-Methylene Dioxy Benzene
IUPAC Name: 1,3-benzodioxole | CAS Registry Number: 274-09-9
Synonyms: Benzodioxole, 1,3-BENZODIOXOLE, 1,3-Dioxaindan, 1,3-Dioxindan, Methylenedioxybenzene, 1,3-Benzodioxolane, 1,2-Methylenedioxybenzene, 2H-1,3-Benzodioxole, 3,4-Methylenedioxybenzene, o-Methylenedioxybenzene, o-(Methylenedioxy)benzene, (Methylenedioxy)benzene, 1,2-(Methylenedioxy)benzene, Benzene, 1,2-methylenedioxy-, Benzene, 1,2-(methylenedioxy)-, ghl.PD_Mitscher_leg0.1027, 159166_ALDRICH, WLN: T56 BO DO CHJ, CHEBI:38732, EINECS 205-992-0

Molecular Formula: C7H6O2Molecular Weight: 122.121340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FTNJQNQLEGKTGD-UHFFFAOYSA-N

• 3,5 - Diamino-2,4,6-Trimethyl Benzene Sulfonic Acid
IUPAC Name: 3,5-diamino-2,4,6-trimethylbenzenesulfonic acid | CAS Registry Number: 32432-55-6
Synonyms: Diaminomesitylenesulfonic acid, EINECS 251-039-7, CID94430, BRN 3323474, LS-31851, 3,5-Diamino-2,4,6-trimethylbenzenesulfonic acid, 3,5-Diamino-2,4,6-trimethylbenzenesulphonic acid, Benzenesulfonic acid, 3,5-diamino-2,4,6-trimethyl-, 2-14-00-00453 (Beilstein Handbook Reference)

Molecular Formula: C9H14N2O3SMolecular Weight: 230.284060 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: PKKGGWLTUCMSSD-UHFFFAOYSA-N

• 3,5,6-Trichloro-2-Pyridinol
IUPAC Name: 3,5,6-trichloro-1H-pyridin-2-one | CAS Registry Number: 6515-38-4
Synonyms: Caswell No. 821AA, 3,5,6-Trichloro-2-pyridone, 3,5,6-TRICHLORO-2-PYRIDINOL, 3,5,6-Trichloro-2(1H)-pyridinone, 33972_RIEDEL, 3,5,6-Trichloropyridine-2-ol, 2-Hydroxy-3,5,6-trichloropyridine, 33972_FLUKA, EINECS 229-405-2, 2(1H)-Pyridinone, 3,5,6-trichloro-, MolPort-003-930-491, EPA Pesticide Chemical Code 206900, CID23017, 2,3,5-Trichloro-6-hydroxypyridine, 37439-34-2 (hydrochloride salt), 3,5,6-trichloro-2-pyridinol sodium salt, LS-133068, TL8004617, C012587, TCP

Molecular Formula: C5H2Cl3NOMolecular Weight: 198.434480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WCYYAQFQZQEUEN-UHFFFAOYSA-N

• 3,5-Bis(trifluoromethyl)benzylamine
IUPAC Name: [3,5-bis(trifluoromethyl)phenyl]methanamine | CAS Registry Number: 85068-29-7
Synonyms: 263389_ALDRICH, JRD-0285, EINECS 285-290-9, SBB000829, [3,5-Bis(trifluoromethyl)phenyl]methanamine, TL8005556

Molecular Formula: C9H7F6NMolecular Weight: 243.148999 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: DHVHORCFFOSRBP-UHFFFAOYSA-N

• 3,5-Di(trifluoromethyl) Benzonitrile
IUPAC Name: 3,5-bis(trifluoromethyl)benzonitrile | CAS Registry Number: 27126-93-8
Synonyms: NCIOpen2_005426, 3,5-Bis(trifluoromethyl)benzonitrile, 3,5-di(Trifluoromethyl)benzonitrile, CID96746, NSC88316, EINECS 248-240-7, ZINC00155235, ST5307057, TL8002188, D1144

Molecular Formula: C9H3F6NMolecular Weight: 239.117239 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: CZKHHAOIHXHOSR-UHFFFAOYSA-N

• 3,5-Di-tert-butyl-2-hydroxybenzaldehyde
IUPAC Name: 3,5-ditert-butyl-2-hydroxybenzaldehyde | CAS Registry Number: 37942-07-7
Synonyms: 140414_ALDRICH, STOCK1S-62613, 3,5-Di-tert-butylsalicylaldehyde, ZINC00056444, 3,5-ditert-butyl-2-hydroxybenzaldehyde, Benzaldehyde, 2-hydroxy, 3,5-di(t-butyl), TL8002784, 3,5-Bis(1,1-dimethylethyl)-2-hydroxy-benzaldehyde, InChI=1/C15H22O2/c1-14(2,3)11-7-10(9-16)13(17)12(8-11)15(4,5)6/h7-9,17H,1-6H

Molecular Formula: C15H22O2Molecular Weight: 234.333980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RRIQVLZDOZPJTH-UHFFFAOYSA-N

• 3,5-Dibenzyloxybenzoic Acid
IUPAC Name: 3,5-bis(phenylmethoxy)benzoic acid | CAS Registry Number: 28917-43-3
Synonyms: 3,5-dibenzyloxybenzoic acid, MLS001195542, Benzoic acid, 3,5-dibenzyloxy-, 3,5-Bis(phenylmethoxy)benzoic acid, EINECS 249-311-5, NSC210283, Benzoic acid, 3,5-bis(phenylmethoxy)-, 3,5-bis(benzyloxy)benzenecarboxylic acid, SMR000550298, TL8005877, 5W-0042

Molecular Formula: C21H18O4Molecular Weight: 334.365220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: DHQIBPUGSWVDOH-UHFFFAOYSA-N

• 3,5-Dibromobenzoic Acid
IUPAC Name: 3,5-dibromobenzoic acid | CAS Registry Number: 618-58-6
Synonyms: 3,5-Dibromobenzoic acid, Maybridge1_003318, BENZOIC ACID, 3,5-DIBROMO-, 411523_ALDRICH, 33960_FLUKA, BRN 1940691, CID12063, LS-36758, ST5319508, TL8003964, 4-09-00-01028 (Beilstein Handbook Reference), InChI=1/C7H4Br2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11

Molecular Formula: C7H4Br2O2Molecular Weight: 279.913460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SFTFNJZWZHASAQ-UHFFFAOYSA-N

• 3,5-Dichloro Benzonitrile
IUPAC Name: 3,5-dichlorobenzonitrile | CAS Registry Number: 6575-00-4
Synonyms: 3,5-Dichlorobenzonitrile, Benzonitrile, 3,5-dichloro-, 139394_ALDRICH, EINECS 229-495-3, NSC109596, ZINC00159427, AI3-34463, ST5308522, TL8004663, InChI=1/C7H3Cl2N/c8-6-1-5(4-10)2-7(9)3-6/h1-3

Molecular Formula: C7H3Cl2NMolecular Weight: 172.011420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PUJSUOGJGIECFQ-UHFFFAOYSA-N

• 3,5-Dichloro-4-fluoronitrobenzene
IUPAC Name: 1,3-dichloro-2-fluoro-5-nitrobenzene | CAS Registry Number: 3107-19-5
Synonyms: ZINC02504546, CID76554, EINECS 221-466-3, 1,3-Dichloro-2-fluoro-5-nitrobenzene, SL-00584, TL80074054

Molecular Formula: C6H2Cl2FNO2Molecular Weight: 209.989983 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VMAATSFMXSMKPG-UHFFFAOYSA-N

• 3,5-Dichlorobenzoic Acid
IUPAC Name: 3,5-dichlorobenzoic acid | CAS Registry Number: 51-36-5
Synonyms: 3,5-DICHLOROBENZOIC ACID, Benzoic acid, 3,5-dichloro-, DICHLOROBENZOIC ACID, PS1107_SUPELCO, D57507_ALDRICH, 35321_FLUKA, EINECS 200-092-4, BRN 2044776, LS-155, AI3-27555, NCGC00091834-01, ST5308119, 4-09-00-01008 (Beilstein Handbook Reference), InChI=1/C7H4Cl2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11, 75248-87-2

Molecular Formula: C7H4Cl2O2Molecular Weight: 191.011460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CXKCZFDUOYMOOP-UHFFFAOYSA-N

• 3,5-Dichlorosalicylic Acid
IUPAC Name: 3,5-dichloro-2-hydroxybenzoic acid | CAS Registry Number: 320-72-9
Synonyms: Salicylic acid, 3,5-dichloro-, 3,5-DICHLOROSALICYLIC ACID, USAF DO-68, 3,5-Dichloro-2-hydroxybenzoic acid, WLN: QVR BQ CG EG, Oprea1_584773, Benzoic acid, 3,5-dichloro-2-hydroxy-, HSDB 5562, 2-Hydroxy-3,5-dichlorobenzoic acid, 254681_ALDRICH, EINECS 206-281-8, NSC 30109, AIDS167492, AIDS-167492, NSC30109, BRN 2210803, SBB003480, AI3-22601, LS-144290, 4-10-00-00213 (Beilstein Handbook Reference)

Molecular Formula: C7H4Cl2O3Molecular Weight: 207.010860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: CNJGWCQEGROXEE-UHFFFAOYSA-N

• 3,5-Difluoro Phenol
IUPAC Name: 3,5-difluorophenol | CAS Registry Number: 2713-34-0
Synonyms: 3,5-Difluorophenol, Ambap75, Phenol,3,5-difluoro-, phenol derivative, 6, Phenol, 3,5-difluoro-, 197572_ALDRICH, JRD-0083, ZINC00406989, TL8002192

Molecular Formula: C6H4F2OMolecular Weight: 130.092166 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HJSSBIMVTMYKPD-UHFFFAOYSA-N

• 3,5-Difluoro Phenyl Acetic Acid
IUPAC Name: 2-(3,5-difluorophenyl)acetic acid | CAS Registry Number: 105184-38-1
Synonyms: 3,5-Difluorophenylacetic acid, 290440_ALDRICH, JRD-0005, SBB006660, TL8000200, InChI=1/C8H6F2O2/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4H,3H2,(H,11,12

Molecular Formula: C8H6F2O2Molecular Weight: 172.128846 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IGGNSAVLXJKCNH-UHFFFAOYSA-N

• 3,5-Dihydroxy Benzaldehyde
IUPAC Name: 3,5-dihydroxybenzaldehyde | CAS Registry Number: 26153-38-8
Synonyms: 3,5-Dihydroxybenzaldehyde, .alpha.-Resorcylic aldehyde, Benzaldehyde, 3,5-dihydroxy-, 368113_ALDRICH, 37523_FLUKA, CHEBI:50204, EINECS 247-479-4, ZINC02566024, FR-2389, InChI=1/C7H6O3/c8-4-5-1-6(9)3-7(10)2-5/h1-4,9-10

Molecular Formula: C7H6O3Molecular Weight: 138.120740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HAQLHRYUDBKTJG-UHFFFAOYSA-N

• 3,5-Dihydroxy-4-methylbenzoic acid
IUPAC Name: 3,5-dihydroxy-4-methylbenzoic acid | CAS Registry Number: 28026-96-2
Synonyms: CID2748045, ST5407062, TL8002237, InChI=1/C8H8O4/c1-4-6(9)2-5(8(11)12)3-7(4)10/h2-3,9-10H,1H3,(H,11,12

Molecular Formula: C8H8O4Molecular Weight: 168.146720 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: KMRRXSZDSGYLCD-UHFFFAOYSA-N

• 3,5-Dihydroxy-A-Bromoacetophenone
IUPAC Name: 2-bromo-1-(3,5-dihydroxyphenyl)ethanone | CAS Registry Number: 62932-92-7
Synonyms: 2-bromo-1-(3,5-dihydroxyphenyl)ethanone, 3',5'-Dihydroxyphenacyl bromide, 3,5-Dihydroxy-alfa-bromoacetophenone, ZINC02507126, zlchem 1042, AC1MBUOV, CTK5B6704, ZLD0508, AKOS015960607, AB13915, AG-G-32108, KB-168651, Ethanone,2-bromo-1-(3,5-dihydroxyphenyl)-, FT-0640857, 1-[3,5-bis(oxidanyl)phenyl]-2-bromanyl-ethanone, A834099, 2-BROMO-1-(3,5-DIHYDROXYPHENYL)ETHAN-1-ONE, ETHANONE, 2-BROMO-1-(3,5-DIHYDROXYPHENYL)-, 2-Bromo-1-(3,5-dihydroxyphenyl)ethanone;3,5-Dihydroxy-A'A|AfA-bromoacetophenone;3',5'-Dihydroxyphenacyl bromide;

Molecular Formula: C8H7BrO3Molecular Weight: 231.043380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WUXKAYZEXYAYIT-UHFFFAOYSA-N

• 3,5-DihydroxyAcetophenone
IUPAC Name: 1-(3,5-dihydroxyphenyl)ethanone | CAS Registry Number: 51863-60-6
Synonyms: 3,5-Dihydroxyacetophenone, 3',5'-Dihydroxyacetophenone, 224596_ALDRICH, ZINC02242686, EINECS 257-480-1, CID103993, 1-(3,5-Dihydroxyphenyl)ethan-1-one, TL806239, D-3420, InChI=1/C8H8O3/c1-5(9)6-2-7(10)4-8(11)3-6/h2-4,10-11H,1H

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

InChIKey: WQXWIKCZNIGMAP-UHFFFAOYSA-N

• 3,5-Dimethoxy Benzamide
IUPAC Name: 3,5-dimethoxybenzamide | CAS Registry Number: 17213-58-0
Synonyms: 3,5-Dimethoxybenzamide, Benzamide, 3,5-dimethoxy-, Oprea1_549641, D131202_ALDRICH, AIDS018407, AIDS-018407, NSC16615, EINECS 241-257-0, ZINC00161726, ST5406388, TL8001354, InChI=1/C9H11NO3/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3,(H2,10,11

Molecular Formula: C9H11NO3Molecular Weight: 181.188540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: YTLRWVNYANKXOW-UHFFFAOYSA-N

• 3,5-Dimethoxybenzoic Acid
IUPAC Name: 3,5-dimethoxybenzoic acid | CAS Registry Number: 1132-21-4
Synonyms: 3,5-DIMETHOXYBENZOIC ACID, Benzoic acid, 3,5-dimethoxy-, D132004_ALDRICH, NSC8514, AIDS018092, AIDS-018092, NSC 8514, NSC43744, EINECS 214-473-8, NSC 43744, SBB007798, AI3-52341, TL8000393, AK-968/40724491, InChI=1/C9H10O4/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3,(H,10,11

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IWPZKOJSYQZABD-UHFFFAOYSA-N

• 3,5-Dimethoxybenzoyl Hydrazine
IUPAC Name: 3,5-dimethoxybenzohydrazide | CAS Registry Number: 51707-38-1
Synonyms: 3,5-Dimethoxybenzoylhydrazine, AIDS018528, AIDS-018528, 3,5-Dimethoxybenzoic acid hydrazide, NSC525793, STK281624, ZINC00394889, 3,5-Dimethoxybenzoic acid, hydrazide, 3,5-DIMETHOXYBENZOIC HYDRAZIDE, Benzoic acid, 3,5-dimethoxy hydrazide, TL8003420

Molecular Formula: C9H12N2O3Molecular Weight: 196.203180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: DOWVACHORBOSEF-UHFFFAOYSA-N

• 3,5-Dimethyl-2-hydroxymethyl-4-methoxypyridine
IUPAC Name: (4-methoxy-3,5-dimethylpyridin-2-yl)methanol | CAS Registry Number: 86604-78-6
Synonyms: Maybridge3_003975, 522465_ALDRICH, EINECS 289-258-5, ZINC00169159, IDI1_015362, KM 07183, 4-Methoxy-3,5-dimethyl-2-pyridinemethanol, 4-Methoxy-3,5-dimethylpyridine-2-methanol, TL8005623, (4-methoxy-3,5-dimethylpyridin-2-yl)methanol, 2-hydroxymethyl-3,5-dimethyl-4-methoxypyridine, AE-641/40197951, SR-01000645003-1, InChI=1/C9H13NO2/c1-6-4-10-8(5-11)7(2)9(6)12-3/h4,11H,5H2,1-3H

Molecular Formula: C9H13NO2Molecular Weight: 167.205020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PSEPRWKZZJWRCB-UHFFFAOYSA-N

• 3,9-Dibromo Benzanthrone
IUPAC Name: 3,9-dibromobenzo[a]phenalen-7-one | CAS Registry Number: 81-98-1
Synonyms: 3,9-Dibrombenzanthrone, 3,9-Dibromobenzanthrone, 2,7-Dibromomesobenzanthrone, Benzanthrone, 3,9-dibromo-, 6-Bz-1-dibrombenzanthron, 6-Bz-1-Dibrombenzanthron [Czech], STOCK3S-48269, EINECS 201-391-2, NSC 84191, NSC84191, BRN 2055712, ZINC04578281, 3,9-Dibromo-7H-benz(de)anthracen-7-one, 3,9-Dibromo-benzo[de]anthracen-7-one, 7H-Benz(de)anthracen-7-one, 3,9-dibromo-, BAS 00112015, LS-27948, 3,9-Dibromo-7H-benz[de]anthracen-7-one, WLN: L C6666 1A Q IVJ FE OE, 7H-Benz[de]anthracen-7-one, 3,9-dibromo-

Molecular Formula: C17H8Br2OMolecular Weight: 388.052820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XBZKJGBIPSQKAU-UHFFFAOYSA-N

• 3-(1-Cyanoethyl)benzoic Acid
IUPAC Name: 3-(1-cyanoethyl)benzoic acid | CAS Registry Number: 320730-08-3
Synonyms: 3-(1-Cyanoethyl)benzoic acid, 5537-71-3, Benzoic acid, 3-(1-cyanoethyl)-, m-(1-Cyanoethyl)benzoic acid, NSC113992, zlchem 504, AC1Q4QLY, SureCN687298, ACMC-1B01Z, 3-(2-Hydroxyethyl)benzoicacid, 209805_ALDRICH, AC1L404C, BEN620, CTK4G8166, ZLC0369, MolPort-002-461-961, Benzoic acid,3-(2-hydroxyethyl)-, EINECS 226-897-0, ANW-32301, AR-1E5883

Molecular Formula: C10H9NO2Molecular Weight: 175.183960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IRYIYPWRXROPSX-UHFFFAOYSA-N

• 3-(2-Aminopropyl)indole
IUPAC Name: 1-(1H-indol-3-yl)propan-2-amine | CAS Registry Number: 299-26-3
Synonyms: Indopan, alpha-Methyltryptamine, .alpha.-Methyltryptamine, indopan, (+-)-isomer, (+-)-alpha-Methyltryptamine, DL-3-(2-Aminopropyl)indole, It-290(dl), Oprea1_004262, u-14164e(dl), alpha-Methyl-beta-indoleethylamine, IT-403(D), U 14 (VAN), INDOLE, 3-(2-AMINOPROPYL)-, Ro 3-0926, EINECS 206-073-7, IT-290(D,L), WLN: T56 BMJ D1YZ1, alpha-Methyl-1H-indole-3-ethanamine, NSC 97069, 164E

Molecular Formula: C11H14N2Molecular Weight: 174.242260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: QSQQQURBVYWZKJ-UHFFFAOYSA-N

• 3-(N,N-Dihydroxyethyl)Amino-4-Methoxy Acetanilide
IUPAC Name: N-[3-[bis(2-hydroxyethyl)amino]-4-methoxyphenyl]acetamide | CAS Registry Number: 24530-67-4
Synonyms: 556742_ALDRICH, EINECS 246-300-7, 4-Acetylamino-2-(bis(2-hydroxyethyl)amino)anisole, 3'-[Bis(2-hydroxyethyl)amino]-4'-methoxyacetamilde, N-(3-(Bis(2-hydroxyethyl)amino)-4-methoxyphenyl)acetamide, Acetamide, N-(3-(bis(2-hydroxyethyl)amino)-4-methoxyphenyl)-, 58195-14-5

Molecular Formula: C13H20N2O4Molecular Weight: 268.308900 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: UIQVGOZJVVAPOV-UHFFFAOYSA-N

• 3-Amino-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
IUPAC Name: 3-amino-1,3,4,5-tetrahydro-1-benzazepin-2-one | CAS Registry Number: 86499-35-6
Synonyms: 3-amino-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one, 3-Amino-2,3,4,5-tetrahydro-1H-benzazepin-2-one, 3-Amino-1,3,4,5-tetrahydro-benzo[b]azepin-2-one, 3-amino-4,5-dihydro-1H-benzo[b]azepin-2(3H)-one, 3-Amino-2,3,4,5-Tetrahydro-1H-1-benzazepin-2-one, AG-H-48945, 3-Amino-2-Oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepine, ACMC-20mwet, PubChem16166, AC1NAXV3, SureCN1270022, 2H-1-Benzazepin-2-one,3-amino-1,3,4,5-tetrahydro-, (3R)-, STOCK7S-10370, CTK5F6863, MolPort-000-000-286, ANW-45348, BBL011254, STK938312, WTI-10315, AKOS005208090

Molecular Formula: C10H12N2OMolecular Weight: 176.215080 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: AUAKXRGQXZRTQC-UHFFFAOYSA-N

• 3-Amino-2-bromo-6-methylpyridine
IUPAC Name: 4-bromo-2-methylpyridin-3-amine | CAS Registry Number: 126325-48-2
Synonyms: 4-Bromo-2-methylpyridin-3-amine, SureCN2596902, KSC915A1F, AGN-PC-001CZ5, CTK8B5012, MolPort-021-783-071, ACT01261, ANW-47034, AKOS015950847, AK-76394

Molecular Formula: C6H7BrN2Molecular Weight: 187.037180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ORELOTUWTIKRIW-UHFFFAOYSA-N

• 3-amino-3-(furan-2-yl)-propionic Acid
IUPAC Name: 3-amino-3-furan-2-ylpropanoic acid | CAS Registry Number: 73456-99-2
Synonyms: Oprea1_170298, Oprea1_274685, ZERO/001588, ALBB-006074, 3-amino-3-(2-furyl)propanoic acid, 2-Furanpropionic acid, .beta.-amino-, 3-Amino-3-furan-2-yl-propionic acid, Propanoic acid, 3-amino-3-(2-furyl)-, BAS 00919057, EU-0099961

Molecular Formula: C7H9NO3Molecular Weight: 155.151260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: YIKVKIOGYSPIMP-UHFFFAOYSA-N

• 3-Amino-4-FluoroBenzotrifluoride
IUPAC Name: 2-fluoro-5-(trifluoromethyl)aniline | CAS Registry Number: 535-52-4
Synonyms: 3-Amino-4-fluorobenzotrifluoride, 2-Fluoro-5-(trifluoromethyl)aniline, 285056_ALDRICH, ALBB-001513, JRD-0384, NSC10327, ZINC01706172, alpha,alpha,alpha,6-Tetrafluoro-m-toluidine, ST5405104, .alpha.,.alpha.,.alpha.,6-Tetrafluoro-m-toluidine

Molecular Formula: C7H5F4NMolecular Weight: 179.114913 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: DRKWGMXFFCPZLW-UHFFFAOYSA-N

• 3-Amino-5-Chlorobenzotrifluoride
IUPAC Name: 3-chloro-5-(trifluoromethyl)aniline | CAS Registry Number: 69411-05-8
Synonyms: 3-Amino-5-chlorobenzotrifluoride, EINECS 273-989-1, 3-Chloro-5-(trifluoromethyl)aniline, JRD-1330, ZINC02583915, CID3017933, TL80074070

Molecular Formula: C7H5ClF3NMolecular Weight: 195.569510 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OVENUGPMQDFGLE-UHFFFAOYSA-N

• 3-Amino-5-methylbenzotrifluoride
IUPAC Name: 3-methyl-5-(trifluoromethyl)aniline | CAS Registry Number: 96100-12-8
Synonyms: 3-methyl-5-thifluoromethylaniline, ZINC02382276, CID2737713, TL8006004

Molecular Formula: C8H8F3NMolecular Weight: 175.151030 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: WYDJMBLMXGCHOL-UHFFFAOYSA-N

• 3-Amino-5-methylisoxazole
IUPAC Name: 5-methyl-1,2-oxazol-3-amine | CAS Registry Number: 1072-67-9
Synonyms: 5-Methyl-3-isoxazolamine, 3-Isoxazolamine, 5-methyl-, 3-Methyl-5-aminoisoxazole, 5-Methyl-3-aminoisoxazole, Isoxazole, 3-amino-5-methyl-, 5-Methylisoxazol-3-ylamine, 5-methylisoxazol-3-amine, 232270_ALDRICH, EINECS 214-013-6, NSC159134, NSC 159134, 3-AMINO-5-METHYL ISOXAZOLE, CID66172, SBB005553, ZINC01610351, AI3-62721, Isoxazole, 3-amino-5-methyl- (8CI), SDCCGMLS-0066220.P001, LS-195291, InChI=1/C4H6N2O/c1-3-2-4(5)6-7-3/h2H,1H3,(H2,5,6

Molecular Formula: C4H6N2OMolecular Weight: 98.103240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FKPXGNGUVSHWQQ-UHFFFAOYSA-N


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