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Kingchem LLC

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Profile: kingchem LLC specializes in serving pharmaceutical, nutraceutical and chemical industries. Our product line includes 2-acetylsalicyloyl chloride, 2- adamantanol, 2-amino-4-chlorophenol, 2-amino-4-chlorophenol. Our nutraceuticals products include includes botanical extracts, vitamins, marine products, mineral and special ingredients.

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• 2,4-Dimethyl-3-Pyridinecarboxylic Acid Hydrochloride
IUPAC Name: 2,4-dimethylpyridine-3-carboxylate | CAS Registry Number: 55314-30-2
Synonyms: ZINC04202615

Molecular Formula: C8H8NO2-Molecular Weight: 150.154620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XSZKVKMGSAAAJZ-UHFFFAOYSA-M

• 4-(Trifluoromethoxy)iodobenzene
IUPAC Name: 1-iodo-4-(trifluoromethoxy)benzene | CAS Registry Number: 103962-05-6
Synonyms: 1-Iodo-4-(trifluoromethoxy)benzene, 4-iodotrifluoromethoxybenzene, p-(trifluoromethoxy)iodobenzene, 1-Iado-4-(trifluoromethoxy)benzene, alpha,alpha,alpha-Trifluoro-4-iodoanisole, 4-(Trifluoromethoxy)-iodobenzene, 4-Iodo-alpha,alpha,alpha-trifluoromethoxybenzene, AG-D-15539, ST51041558, ZINC00167109, PubChem1078, AC1MCRLU, SureCN80634, KSC490I9B, ACMC-20989z, 4-iodo trifluoromethoxy benzene, 535990_ALDRICH, Jsp000399, 1-Iodo-4-trifluoromethoxybenzene, 4-(Trifluoromethoxy) iodobenzene

Molecular Formula: C7H4F3IOMolecular Weight: 288.005740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RTUDBROGOZBBIC-UHFFFAOYSA-N

• 2-Bromo-4-Fluoroaniline
IUPAC Name: 2-bromo-4-fluoroaniline | CAS Registry Number: 1003-98-1
Synonyms: 2-Bromo-4-fluoroaniline, 2-Bromo-4-fluorobenzenamine, 369055_ALDRICH, NSC51870, CID242873, ZINC00159787, ST5408548, TL8000048

Molecular Formula: C6H5BrFNMolecular Weight: 190.013003 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YLMFXCIATJJKQL-UHFFFAOYSA-N

• 5,6-Dimethyl-1,2,3-benzotriazole hydrate
IUPAC Name: 5,6-dimethyl-2H-benzotriazole | CAS Registry Number: 4184-79-6
Synonyms: 5,6-Dimethylbenzotriazole, 5,6-Dimethyl-1H-benzotriazole, NSC62005, 1H-Benzotriazole, 5,6-dimethyl-, CID77849, EINECS 224-058-3, SBB004093, AI3-52170

Molecular Formula: C8H9N3Molecular Weight: 147.177160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MVPKIPGHRNIOPT-UHFFFAOYSA-N

• 5-Chlorooxindole
IUPAC Name: 5-chloro-1,3-dihydroindol-2-one | CAS Registry Number: 17630-75-0
Synonyms: 127485_ALDRICH, ALBB-006976, 5-Chloro-1,3-dihydro-2H-indol-2-one, 5-Chloro-1,3-dihydro-indol-2-one, SBB003879, ZINC00161358, Indol-2-one, 5-chloro-1,3-dihydro-, 7-Chloro-1,3-dihydro-2H-indol-2-one, 2H-Indol-2-one, 7-chloro-1,3-dihydro-, TL8001400, C-5240, SR-01000637295-1, 25369-33-9, InChI=1/C8H6ClNO/c9-6-1-2-7-5(3-6)4-8(11)10-7/h1-3H,4H2,(H,10,11

Molecular Formula: C8H6ClNOMolecular Weight: 167.592340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WWJLCYHYLZZXBE-UHFFFAOYSA-N

• 16-Dehydropregnenolone Acetate
IUPAC Name: [(3S,8R,9S,10R,13S,14S)-17-acetyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate | CAS Registry Number: 979-02-2
Synonyms: Dehydropregnenolone acetate, 16-Dehydropregnenolone acetate, 16,17-Didehydropregnenolone acetate, EINECS 213-558-7, NSC 37741, CID92855, NSC37741, BRN 1026798, 3beta-Acetoxypregna-5,16-dien-20-one, ZINC02105100, 20-Oxopregna-5,16-dien-3beta-yl acetate, KS-1008, 20-Oxopregna-5,16-dien-3-beta-yl acetate, 3.beta.-Acetoxypregna-5,16-dien-20-one, 3beta-Acetyloxy-pregna-5,16-dien-20-one, LS-118517, (3-beta)-3-(Acetyloxy)pregna-5,16-dien-20-one, 20-Oxopregna-5,16-dien-3.beta.-yl acetate, C14503, Pregna-5,16-dien-20-one, 3-beta-hydroxy-, acetate

Molecular Formula: C23H32O3Molecular Weight: 356.498380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MZWRIOUCMXPLKV-RFOVXIPZSA-N

• 7-Methoxy-1-tetralone
IUPAC Name: 7-methoxy-3,4-dihydro-2H-naphthalen-1-one | CAS Registry Number: 6836-19-7
Synonyms: NCIOpen2_001805, 163368_ALDRICH, NSC97611, EINECS 229-916-0, ZINC04521666, 1(2H)-Naphthalenone, 3,4-dihydro-7-methoxy-, ST5408201, 7-Methoxy-1,2,3,4-tetrahydronaphthalen-1-one

Molecular Formula: C11H12O2Molecular Weight: 176.211780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GABLTKRIYDNDIN-UHFFFAOYSA-N

• 2-Amino-5-tert-butyl-1,3,4-thiadiazole
IUPAC Name: 5-tert-butyl-1,3,4-thiadiazol-2-amine | CAS Registry Number: 39222-73-6
Synonyms: Enamine_005678, 524409_ALDRICH, ZERO/005496, ALBB-000319, EINECS 254-364-2, ZINC03882373, 5-tert-Butyl-1,3,4-thiadiazol-2-amine, IDI1_007913, 1,3,4-Thiadiazol-2-amine, 5-(1,1-dimethylethyl)-

Molecular Formula: C6H11N3SMolecular Weight: 157.236640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ICXDPEFCLDSXLI-UHFFFAOYSA-N

• 3,5-Difluorobenzaldehyde
IUPAC Name: 3,5-difluorobenzaldehyde | CAS Registry Number: 32085-88-4
Synonyms: 290173_ALDRICH, ZINC00164753, JRD-0258, CID588160, SB 01678

Molecular Formula: C7H4F2OMolecular Weight: 142.102866 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ASOFZHSTJHGQDT-UHFFFAOYSA-N

• 2-Hydroxyadamantane
IUPAC Name: adamantan-2-ol | CAS Registry Number: 700-57-2
Synonyms: 2-Adamantanol, Adamantan-2-ol, 153826_ALDRICH, Tricyclo[3.3.1.13,7]decan-2-ol, EINECS 211-846-7, NSC193480, ZINC01733114, Tricyclo(3.3.1.13,7)decan-2-ol, SB 01544, Tricyclo[3.3.1.1<3,7>]decan-2-ol, TL8004936, InChI=1/C10H16O/c11-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-11H,1-5H

Molecular Formula: C10H16OMolecular Weight: 152.233440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: FOWDOWQYRZXQDP-UHFFFAOYSA-N

• 4-Amino-2,6-dihydroxypyrimidine
IUPAC Name: 6-amino-1H-pyrimidine-2,4-dione | CAS Registry Number: 873-83-6
Synonyms: 6-Aminouracil, 4-Aminouracil, Uracil, 6-amino-, Cytosine, 6-hydroxy-, 6-Amino-2,4-pyrimidinediol, 4-Amino-2,6-pyrimidinediol, 4-Amino-2,6-dioxypyrimidine, 6-Amino-2,4-dihydroxypyrimidine, WLN: T6MVMVJ FZ, 4-Amino-2,6-dihydroxylpyrimidine, 6-aminopyrimidine-2,4-diol, Uracil, 6-amino- (VAN), A50606_ALDRICH, NSC 7367, 09630_FLUKA, 2,4(1H,3H)-Pyrimidinedione, 6-amino-, EINECS 212-854-3, NSC7367, NSC 15919, AIDS023069

Molecular Formula: C4H5N3O2Molecular Weight: 127.101400 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: LNDZXOWGUAIUBG-UHFFFAOYSA-N

• 7-Nitroindole
IUPAC Name: 7-nitro-1H-indole | CAS Registry Number: 6960-42-5
Synonyms: 7-Nitro-1H-indole, 1H-Indole, 7-nitro-, INDOLE, 7-NITRO-, nchembio873-comp34, 7-Nitro-1H-indazole, 638854_ALDRICH, 1H-Indole, 7-nitro- (9CI), NSC 69874, NSC69874, BRN 0130874, SBB003947, STK249657, ZINC01695861, LS-83316, TL806417, N-3040, 5-20-07-00044 (Beilstein Handbook Reference)

Molecular Formula: C8H6N2O2Molecular Weight: 162.145440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LZJGQIVWUKFTRD-UHFFFAOYSA-N

• 2',4',6'-Trihydroxypropiophenone
IUPAC Name: 1-(2,4,6-trihydroxyphenyl)propan-1-one | CAS Registry Number: 2295-58-1
Synonyms: flopropione, Chlonarin, Flopropion, Gasstenon, Cospanon, Labrodax, Supanate, Supazlun, Argobyl, Ecapron, Labroda, Phloropropionone, Labrodax supanate, Phloropropiophenone, Propiophloroglucine, Ephtanon, Propionylphloroglucinol, Ephtanon (TN), Ambap7630, Spectrum_000563

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: PTHLEKANMPKYDB-UHFFFAOYSA-N

• 2,3,5-Trichlorobenzaldehyde
IUPAC Name: 2,3,5-trichlorobenzaldehyde | CAS Registry Number: 56961-75-2
Synonyms: Benzaldehyde, 2,3,5-trichloro-, 292338_ALDRICH, SBB003454, ZINC02539407

Molecular Formula: C7H3Cl3OMolecular Weight: 209.457120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: DJYRZTCLVDKWBL-UHFFFAOYSA-N

• 1-Cyclo Propyl-7- Chloro-6 Fluoro 1,4-Dihydro 4-Oxo-Quinoline-3-Carboxylic Acid
IUPAC Name: 7-chloro-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid | CAS Registry Number: 86393-33-1
Synonyms: Q-Acid, Fluoroquinolonic acid, Fluorchinoloncarbonsaure, Oprea1_261968, 531901_ALDRICH, SBB003016, EE4050500, LS-141562, 7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid, 3-Quinolinecarboxylic acid, 1,4-dihydro-7-chloro-1-cyclopropyl-6-fluoro-4-oxo-, 7-Chloor-1-cyclopropyl-6-fluor-1,4-dihydro-4-oxochinoline-3-carbonzuur [Dutch], 7-Chlor-1-cyclopropyl-6-fluor-1,4-dihydro-4-oxochinolin-3-carbonsaure [German], 7-Chlor-1-cyclopropyl-6-fluor-1,4-dihydro-4-oxoquinolin-3-carboxylsyre [Danish], 7-Chloro 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid, 7-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid, Acide 7-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxoquinoleine-3-carboxylique [French], Acido 7-cloro-1-ciclopropil-6-fluoro-1,4-dihidro-4-oxoquinolina-3-carboxilico [Portuguese], Acido 7-cloro-1-ciclopropil-6-fluoro-1,4-dihidro-4-oxoquinolina-3-carboxilico [Spanish], Acido 7-cloro-1-ciclopropil-6-fluoro-1,4-diidro-4-ossochinolin-3-carbossilico [Italian]

Molecular Formula: C13H9ClFNO3Molecular Weight: 281.666863 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: ISPVACVJFUIDPD-UHFFFAOYSA-N

• 2,6-Dichloro-4-trifluoromethoxyaniline
IUPAC Name: 2,6-dichloro-4-(trifluoromethoxy)aniline | CAS Registry Number: 99479-66-0
Synonyms: 429899_ALDRICH, JRD-0738, SBB003181, ZINC00056967, 2,6-Dichloro-4-(trifluoromethoxy)aniline, InChI=1/C7H4Cl2F3NO/c8-4-1-3(14-7(10,11)12)2-5(9)6(4)13/h1-2H,13H

Molecular Formula: C7H4Cl2F3NOMolecular Weight: 246.013970 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: FKISQWQHZULEEG-UHFFFAOYSA-N

• 2-Hydroxy Acetophenone
IUPAC Name: 2-hydroxy-1-phenylethanone | CAS Registry Number: 582-24-1
Synonyms: Benzoylcarbinol, Glycolophenone, 2-Hydroxyacetophenone, Phenacyl alcohol, Methanol, benzoyl-, Acetophenone, 2-hydroxy-, omega-Hydroxyacetophenone, alpha-Hydroxyacetophenone, Ethanone, 2-hydroxy-1-phenyl-, .alpha.-Hydroxyacetophenone, .omega.-Hydroxyacetophenone, 445134_ALDRICH, 2-Hydroxy-1-phenylethan-1-one, Acetophenone, 2-hydroxy- (8CI), CID68490, EINECS 209-480-8, c0276, NSC171232, ZINC00396134, NSC 171232

Molecular Formula: C8H8O2Molecular Weight: 136.147920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ZWVHTXAYIKBMEE-UHFFFAOYSA-N

• 2-Amino-5-Nitro Benzophenone
IUPAC Name: (2-amino-5-nitrophenyl)-phenylmethanone | CAS Registry Number: 1775-95-7
Synonyms: 2-Amino-5-nitrobenzophenone, Oprea1_660099, 211737_ALDRICH, EINECS 217-207-9, ZINC03861498, (2-Amino-5-nitrophenyl)phenylmethanone, CID15681, BRN 0748830, SBB000821, METHANONE, (2-AMINO-5-NITROPHENYL)PHENYL-, (2-amino-5-nitrophenyl)(phenyl)methanone, LS-91113, ST5308434, 4-14-00-00246 (Beilstein Handbook Reference)

Molecular Formula: C13H10N2O3Molecular Weight: 242.230100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: PZPZDEIASIKHPY-UHFFFAOYSA-N

• 2-Fluoro Benzaldehyde
IUPAC Name: 2-fluorobenzaldehyde | CAS Registry Number: 446-52-6
Synonyms: 2-Fluorobenzaldehyde, o-Fluorobenzaldehyde, Benzaldehyde, 2-fluoro-, Benzaldehyde, o-fluoro-, F4807_ALDRICH, Benzaldehyde, o-fluoro- (8CI), EINECS 207-171-2, NSC 66829, NSC66829, BRN 0507155, ZINC00157161, LS-25048, ST5213339, 4-07-00-00559 (Beilstein Handbook Reference), InChI=1/C7H5FO/c8-7-4-2-1-3-6(7)5-9/h1-5

Molecular Formula: C7H5FOMolecular Weight: 124.112403 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZWDVQMVZZYIAHO-UHFFFAOYSA-N

• 2-Chloro-4-fluorobenzyl chloride
IUPAC Name: 2-chloro-1-(chloromethyl)-4-fluorobenzene | CAS Registry Number: 93286-22-7
Synonyms: SBB005760, C135

Molecular Formula: C7H5Cl2FMolecular Weight: 179.019003 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HMIAXVWVTBIGON-UHFFFAOYSA-N

• 3-amino-1-propanesulfonic Acid
IUPAC Name: 3-aminopropane-1-sulfonic acid | CAS Registry Number: 3687-18-1
Synonyms: Homotaurine, Tramiprosate, Alzhemed, Cerebril, 3-aminopropanesulphonic acid, 3-Amino-1-propanesulfonic acid, Tramiprosate (USAN), Tramiprosate [USAN], 3-Aminopropanesulfonate, Spectrum_001340, Spectrum2_001409, Spectrum3_000924, Spectrum4_001023, Spectrum5_001319, 3-Aminopropane sulfonic acid, 3-APS, 3-aminopropylsulfonic acid, 1-Propanesulfonic acid, 3-amino-, 3-aminopropanesulfonic acid, C3H9NO3S

Molecular Formula: C3H9NO3SMolecular Weight: 139.173460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: SNKZJIOFVMKAOJ-UHFFFAOYSA-N

• 4-Nitro Benzaldehyde
IUPAC Name: 4-nitrobenzaldehyde | CAS Registry Number: 555-16-8
Synonyms: 4-nitrobenzaldehyde, p-Nitrobenzaldehyde, Benzaldehyde, 4-nitro-, p-Formylnitrobenzene, Benzaldehyde, p-nitro-, para-nitrobenzaldehyde, 4NBZ, WLN: WNR DVH, CCRIS 1675, 130176_ALDRICH, 4-nitrobenzaldehyde, ion(1-), CID541, NSC 6103, 72800_FLUKA, EINECS 209-084-5, CPD-703, NSC6103, ZINC00164513, AI3-52475, 4-nitrobenzaldehyde, 1-(13)C-labeled

Molecular Formula: C7H5NO3Molecular Weight: 151.119500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BXRFQSNOROATLV-UHFFFAOYSA-N

• 5-Methoxy-1-tetralone
IUPAC Name: 5-methoxy-3,4-dihydro-2H-naphthalen-1-one | CAS Registry Number: 33892-75-0
Synonyms: 5-methoxytetralin-1-one, alpha-Tetralone, 5-methoxy-, 113115_ALDRICH, 65354_FLUKA, EINECS 251-723-5, NSC 310000, BRN 2047383, NSC310000, ZINC03882997, 1(2H)-NAPHTHALENONE, 3,4-DIHYDRO-5-METHOXY-, LS-95064, 5-Methoxy-1,2,3,4-tetrahydronaphthalen-1-one, ST5408200, 4-08-00-00903 (Beilstein Handbook Reference)

Molecular Formula: C11H12O2Molecular Weight: 176.211780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BRCPWISABURVIH-UHFFFAOYSA-N

• 4-phenylpyrrolidin-2-one
IUPAC Name: 4-phenylpyrrolidin-2-one | CAS Registry Number: 1198-97-6
Synonyms: Phenylpyrrolidone, 4-Phenylpyrrolidone-2, 4-Phenyl-2-pyrrolidinone, 2-Pyrrolidinone, 4-phenyl-, ChemDiv2_001857, 4-Phenyl-pyrrolidin-2-one, MLS000762405, CID121397, STK006864, SMR000437921, LS-138961

Molecular Formula: C10H11NOMolecular Weight: 161.200440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HOJZEMQCQRPLQQ-UHFFFAOYSA-N

• 2-Methyl mercapto phenothiazine
IUPAC Name: 2-methylsulfanyl-10H-phenothiazine | CAS Registry Number: 7643-08-5
Synonyms: 2-Methylthiophenothiazine, 552925_ALDRICH, 10H-Phenothiazine, 2-(methylthio)-, 2-(Methylthio)-10H-phenothiazine, 2-Methylsulfanyl-10H-phenothiazine, EINECS 231-581-0, SR-03000000755-1, T5655032

Molecular Formula: C13H11NS2Molecular Weight: 245.363140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: OBVKBOLDEFIQDP-UHFFFAOYSA-N

• 3-Amino-4-(Ethoxycarbonyl)-Pyrazole
IUPAC Name: ethyl 5-amino-1H-pyrazole-4-carboxylate | CAS Registry Number: 6994-25-8
Synonyms: 3-Amino-4-carbethoxypyrazole, Maybridge1_004633, ChemDiv2_008143, Pyrazole carboxylic ester 4, A45009_ALDRICH, 3-Amino-4-ethoxycarbonylpyrazole, MLS000104802, ZERO/002887, Ethyl 5-aminopyrazol-4-carboxylate, EINECS 230-262-3, Ethyl 3-amino-4-pyrazolecarboxylate, NSC521580, ZINC04261766, Ethyl 3-amino-1H-pyrazole-4-carboxylate, SMR000054735, ST008471, TL8004916, EU-0096157

Molecular Formula: C6H9N3O2Molecular Weight: 155.154560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: YPXGHKWOJXQLQU-UHFFFAOYSA-N

• 1,3-Dichlorobenzene
IUPAC Name: 1,3-dichlorobenzene | CAS Registry Number: 541-73-1
Synonyms: m-Dichlorobenzene, m-Dichlorobenzol, 1,3-DICHLOROBENZENE, meta-Dichlorobenzene, Benzene, m-dichloro-, m-Phenylene dichloride, Benzene, 1,3-dichloro-, m-Phenylenedichloride, Metadichlorobenzene, m-DCB, RCRA waste no. U071, RCRA waste number U071, CCRIS 4259, HSDB 522, 1,3-Dichlorobenzene solution, 40214_SUPELCO, 48523_SUPELCO, 48638_SUPELCO, 113808_ALDRICH, 36708_RIEDEL

Molecular Formula: C6H4Cl2Molecular Weight: 147.001960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ZPQOPVIELGIULI-UHFFFAOYSA-N

• 4-Methoxybiphenyl
IUPAC Name: 1-methoxy-4-phenylbenzene | CAS Registry Number: 613-37-6
Synonyms: 4-Phenylanisole, p-Methoxybiphenyl, Anisole, p-phenyl-, p-Phenylanisole, 4-METHOXYBIPHENYL, Biphenyl, 4-methoxy, 4-Methoxy-1,1'-biphenyl, 1,1'-Biphenyl, 4-methoxy-, WLN: 1OR DR, CBiol_000842, HSDB 5502, 374776_ALDRICH, NSC 3793, EINECS 210-339-8, NSC3793, CID11943, BRN 2043157, ICCB4_000138, ZINC01080160, AI3-00228

Molecular Formula: C13H12OMolecular Weight: 184.233780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RHDYQUZYHZWTCI-UHFFFAOYSA-N

• 4-Amino-3-trifluoromethylbenzonitrile
IUPAC Name: 4-amino-3-(trifluoromethyl)benzonitrile | CAS Registry Number: 327-74-2
Synonyms: 4-AMINO-3-TRIFLUOROMETHYLBENZONITRILE, 2-Amino-5-cyanobenzotrifluoride, 2-trifluoromethyl-4-cyanoaniline, 4-amino-3-(trifluoromethyl)benzonitrile, 2-amino-5cyano-trifluorotoluene, 4-Cyano-2-(trifluoromethyl)aniline, 3-trifluoromethyl-4-aminobenzonitrile, SBB063343, 4-amino-3-(trifluoromethyl)benzenecarbonitrile, ZINC02564945, PubChem2174, AC1MCVNU, SureCN568905, AC1Q50QD, Jsp006029, CTK7C7494, 2-amino-5-cyano benzotrifluoride, BUTTPARK 87\01-75, MolPort-000-150-995, WT086

Molecular Formula: C8H5F3N2Molecular Weight: 186.133910 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: MWLZJOBGDXBMBP-UHFFFAOYSA-N

• 6-Methyl Uracil
IUPAC Name: 6-methyl-1H-pyrimidine-2,4-dione | CAS Registry Number: 626-48-2
Synonyms: Pseudothymine, 6-METHYLURACIL, 4-Methyluracil, Methacil, Methyluracil, Methacyl, Metacil, Metacyl, Uracil, 6-methyl-, Pseudothymine (VAN), 2,4-Dihydroxy-6-methylpyrimidine, WLN: T6MVMVJ F1, 2,4-Pyrimidinediol, 6-methyl-, 2,4(1H,3H)-Pyrimidinedione, 6-methyl-, HSDB 5508, D115207_ALDRICH, C5H6N2O2, NSC 9456, EINECS 210-949-4, NSC9456

Molecular Formula: C5H6N2O2Molecular Weight: 126.113340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SHVCSCWHWMSGTE-UHFFFAOYSA-N

• 1-Naphthaldehyde
IUPAC Name: naphthalene-1-carbaldehyde | CAS Registry Number: 66-77-3
Synonyms: alpha-Naphthal, 1-Formylnaphthalene, 1-Naphthylaldehyde, Naphthaldehyde, alpha-Naphthaldehyde, I-Napthaldehyde, .alpha.-Naphthal, alpha-Naphthylaldehyde, 1-NAPHTHALENECARBOXALDEHYDE, .alpha.-Naphthaldehyde, alpha-Naphthylcarboxaldehyde, .alpha.-Naphthylaldehyde, N109_ALDRICH, .alpha.-Naphthylcarboxaldehyde, 1-NAPHTHALDEHYDE, REAG, NAPHTHALENECARBOXALDEHYDE, NSC 6106, 70180_FLUKA, EINECS 200-633-4, NSC6106

Molecular Formula: C11H8OMolecular Weight: 156.180620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SQAINHDHICKHLX-UHFFFAOYSA-N

• 5-Methoxy-2-tetralone
IUPAC Name: 5-methoxy-3,4-dihydro-1H-naphthalen-2-one | CAS Registry Number: 32940-15-1
Synonyms: Ambap3620, 579335_ALDRICH, NSC88880, 2(1H)-Naphthalenone, 3,4-dihydro-5-methoxy-

Molecular Formula: C11H12O2Molecular Weight: 176.211780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MDAIAXRTLTVEOU-UHFFFAOYSA-N

• 2-Methoxy phenothiazine
IUPAC Name: 2-methoxy-10H-phenothiazine | CAS Registry Number: 1771-18-2
Synonyms: 2-Methoxyphenothiazine, 2-Methoxy-10H-phenothiazine, 10H-Phenothiazine, 2-methoxy-, Phenothiazine, 2-methoxy-, TimTec1_000536, Oprea1_747823, Methyl phenothiazin-2-yl ether, Phenothiazine, 2-methoxy- (8CI), NSC72107, EINECS 217-195-5, NSC 72107, ZINC00035763, 10H-Phenothiazine, 2-methoxy- (9CI), ST005542, TL8001410, SR-03000000753-1

Molecular Formula: C13H11NOSMolecular Weight: 229.297540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DLYKFPHPBCTAKD-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-Amino-5-methylisoxazole, 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

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

InChIKey: FKPXGNGUVSHWQQ-UHFFFAOYSA-N

• 2-Methoxy-5-Sulfamoyl Benzoic Acid
IUPAC Name: 2-methoxy-5-sulfamoylbenzoic acid | CAS Registry Number: 22117-85-7
Synonyms: 5-Sulphamoyl-o-anisic acid, EINECS 244-789-1, ST5407390

Molecular Formula: C8H9NO5SMolecular Weight: 231.225760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: SQAILWDRVDGLGY-UHFFFAOYSA-N

• 4-Aminoacetophenone
IUPAC Name: 1-(4-aminophenyl)ethanone | CAS Registry Number: 99-92-3
Synonyms: p-Aminoacetophenone, p-Acetylaniline, 4'-Aminoacetophenone, p-Aminoacetylbenzene, 4-ACETYLANILINE, 1-(4-Aminophenyl)ethanone, Acetophenone, p-amino-, Acetophenone, 4'-amino-, nchembio775-comp7, Ethanone, 1-(4-aminophenyl)-, Acetophenone, 4-amino-, p-Aminoacetofenonu [Polish], USAF EK-631, 4-AMINO-ACETOPHENON, WLN: ZR DV1, CCRIS 5061, A38002_ALDRICH, HSDB 2711, NSC 3242, EINECS 202-801-2

Molecular Formula: C8H9NOMolecular Weight: 135.163160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GPRYKVSEZCQIHD-UHFFFAOYSA-N

• 2,4-Dichloro-1-nitrobenzene
IUPAC Name: 2,4-dichloro-1-nitrobenzene | CAS Registry Number: 611-06-3
Synonyms: 2,4-DICHLORONITROBENZENE, 1,3-Dichloro-4-nitrobenzene, Benzene, 2,4-dichloro-1-nitro-, CCRIS 3095, D68401_ALDRICH, ghl.PD_Mitscher_leg0.937, asym.-Nitro-m-dichlorobenzene, HSDB 4267, 36030_FLUKA, EINECS 210-248-3, NSC 43196, NSC43196, BRN 1451655, ZINC01675935, LS-1460, NCGC00091267-01, TL80074006, 4-05-00-00726 (Beilstein Handbook Reference), InChI=1/C6H3Cl2NO2/c7-4-1-2-6(9(10)11)5(8)3-4/h1-3

Molecular Formula: C6H3Cl2NO2Molecular Weight: 191.999520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QUIMTLZDMCNYGY-UHFFFAOYSA-N

• 1-Acetyl-4-(4-Hydroxyphenyl)-Piperazine
IUPAC Name: 1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone | CAS Registry Number: 67914-60-7
Synonyms: Oprea1_786576, 511943_ALDRICH, 1-Acetyl-4-(4-hydroxyphenyl)piperazine, ZINC00105363, EINECS 267-744-8, CID712441, SBB003353, SDCCGMLS-0066236.P001, TL8004782

Molecular Formula: C12H16N2O2Molecular Weight: 220.267640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: AGVNLFCRZULMKK-UHFFFAOYSA-N

• 4-Piperidinol, 4-methyl-
IUPAC Name: 4-methylpiperidin-4-ol | CAS Registry Number: 3970-68-1
Synonyms: 4-METHYLPIPERIDIN-4-OL, 4-Methyl-piperidin-4-ol, 4-methyl-4-piperidinol, 4-PIPERIDINOL, 4-METHYL-, AG-F-40308, PubChem17607, SureCN86857, 4-Piperidinol,4-methyl-, 4-PIPECOLIN-4-OL, AGN-PC-00Q2B7, CTK4I1752, 4-HYDROXY-4-METHYLPIPERIDINE, ANW-74213, AKOS012081783, LS20682, MCULE-9361316232, PB10877, RP08612, AK-79153, AM100764

Molecular Formula: C6H13NOMolecular Weight: 115.173520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: CXBLQEIODBBSQD-UHFFFAOYSA-N

• 3-Fluoroanisole
IUPAC Name: 1-fluoro-3-methoxybenzene | CAS Registry Number: 456-49-5
Synonyms: m-Fluoroanisole, 1-FLUORO-3-METHOXYBENZENE, Benzene, 1-fluoro-3-methoxy-, NCIOpen2_001323, 162310_ALDRICH, NSC88277, EINECS 207-267-4, ZINC00388393, F105, TL8003177, InChI=1/C7H7FO/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H

Molecular Formula: C7H7FOMolecular Weight: 126.128283 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MFJNOXOAIFNSBX-UHFFFAOYSA-N

• 3,4-dihydroxy ethyl benzoate
IUPAC Name: ethyl 3,4-dihydroxybenzoate | CAS Registry Number: 3943-89-3
Synonyms: Ethyl protocatechuate, Ethyl 3,4-dihydroxybenzoate, Ambap72, 3,4-DHBEEOP, E24859_ALDRICH, Protocatechuic acid ethyl ester, Protocatechuic acid, ethyl ester, AIDS018069, AIDS108197, AIDS-018069, AIDS-108197, CID77547, NSC86130, EINECS 223-529-0, NSC 86130, NSC619681, ZINC00403548, 3,4-Dihydroxybenzoic acid, ethyl ester, Benzoic acid, 3,4-dihydroxy-, ethyl ester, 3,4-Dihydroxybenzoic acid, Ethyl ester, homopolymer

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

InChIKey: KBPUBCVJHFXPOC-UHFFFAOYSA-N

• 4-Chloro-3-Nitro Benzophenone
IUPAC Name: (4-chloro-3-nitrophenyl)-phenylmethanone | CAS Registry Number: 56107-02-9
Synonyms: 4-Chloro-3-nitrobenzophenone, Ambap210, EINECS 259-995-7, BENZOPHENONE, 4-CHLORO-3-NITRO-, BRN 2587417, Methanone, (4-chloro-3-nitrophenyl)phenyl-, NSC102519, ZINC00058234, LS-38889, ST5308011, 4-07-00-01383 (Beilstein Handbook Reference)

Molecular Formula: C13H8ClNO3Molecular Weight: 261.660520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YBDBYPQFIMSFJW-UHFFFAOYSA-N

• 1-2(-Hydroxy Ethyl) Piperazine
IUPAC Name: 2-piperazin-1-ylethanol | CAS Registry Number: 103-76-4
Synonyms: 2-Piperazinoethanol, 1-Piperazinethanol, Hydroxyethylpiperazine, 1-PIPERAZINEETHANOL, 2-Hydroxyethylpiperazine, 2-Piperazin-1-ylethanol, 1-(2-Hydroxyethyl)piperazine, Piperazine-1-ethanol, 2-(1-Piperazinyl)ethanol, USAF DO-22, N-(2-Hydroxyethyl)piperazine, 4-(2-Hydroxyethyl)piperazine, Ethanol, 2-(1-piperazinyl)-, (.beta.-Hydroxyethyl)piperazine, N-(Hydroxyethyl)piperazine, CCRIS 6687, N-(beta-Hydroxyethyl)piperazine, 1-(beta-Hydroxyethyl)piperazine, H28807_ALDRICH, WLN: T6M DNTJ D2Q

Molecular Formula: C6H14N2OMolecular Weight: 130.188160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WFCSWCVEJLETKA-UHFFFAOYSA-N

• 2-Fluoro Benzonitrile
IUPAC Name: 2-fluorobenzonitrile | CAS Registry Number: 394-47-8
Synonyms: 2-Fluorobenzonitrile, o-Fluorobenzonitrile, Benzonitrile, 2-fluoro-, o-Cyanofluorobenzene, Benzonitrile, o-fluoro-, NCIOpen2_001363, 196649_ALDRICH, 46675_FLUKA, Benzonitrile, o-fluoro- (8CI), BB_SC-3292, NSC88278, EINECS 206-897-7, NSC 88278, ZINC00164450, 2-FLUORO-BENZOIC ACID-NITRILE, F112, TL8002850, InChI=1/C7H4FN/c8-7-4-2-1-3-6(7)5-9/h1-4

Molecular Formula: C7H4FNMolecular Weight: 121.111763 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GDHXJNRAJRCGMX-UHFFFAOYSA-N

• 2-(Trifluoromethoxy)phenol
IUPAC Name: 2-(trifluoromethoxy)phenol | CAS Registry Number: 32858-93-8
Synonyms: ZINC02560218, CID2777299, ST5407135, TL8002474

Molecular Formula: C7H5F3O2Molecular Weight: 178.108610 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: GQWMNVOVQZIPJC-UHFFFAOYSA-N

• 2,3,4-Trifluoroaniline
IUPAC Name: 2,3,4-trifluoroaniline | CAS Registry Number: 3862-73-5
Synonyms: 2,3,4-Trifluoranilin, Aniline, 2,3,4-trifluoro-, Benzenamine, 2,3,4-trifluoro-, 304352_ALDRICH, 2,3,4-Trifluoranilin [Danish], 2,3,4-Trifluoranilin [German], 2,3,4-Trifluoraniline [Dutch], 2,3,4-Trifluoroaniline [French], 2,3,4-Trifluoroanilina [Italian], 2,3,4-Trifluoroanilina [Spanish], JRD-0607, BRN 3245609, SBB012347, ZINC00164526, 2,3,4-Trifluoroanilina [Portuguese], LS-28441, EE4071709, TL8002814, 4-12-00-01114 (Beilstein Handbook Reference), 3S211006

Molecular Formula: C6H4F3NMolecular Weight: 147.097870 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: WRDGNXCXTDDYBZ-UHFFFAOYSA-N

• 2',3'-Dideoxycytidine
IUPAC Name: 4-amino-1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one | CAS Registry Number: 7481-89-2
Synonyms: zalcitabine, Dideoxycytidine, ddCyd, Zalcitibine, HIVID, 2',3'-DIDEOXYCYTIDINE, ddC (Antiviral), Hivid (TN), PC-SOD+ddC, ddC & IFN.alpha., .beta.-D-DDC, Interferon AD + ddC, ddC & sCD4, ddC & GM-CSF, Prestwick0_001037, Prestwick1_001037, Prestwick2_001037, Prestwick3_001037, ddC & Interferon.alpha., CCRIS 692

Molecular Formula: C9H13N3O3Molecular Weight: 211.217820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: WREGKURFCTUGRC-POYBYMJQSA-N

• 3-Fluoro-4-Methoxy Acetophenone
IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)ethanone | CAS Registry Number: 455-91-4
Synonyms: 3'-Fluoro-4'-methoxyacetophenone, 3-Fluoro-4-methoxyacetophenone, 361836_ALDRICH, Acetophenone, 3'-fluoro-4'-methoxy-, JRD-1511, NSC89731, EINECS 207-253-8, ZINC00157335, 1-(3-Fluoro-4-methoxyphenyl)ethan-1-one, Ethanone, 1-(3-fluoro-4-methoxyphenyl)-, ST5407054, TL8003169

Molecular Formula: C9H9FO2Molecular Weight: 168.164963 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LQASUDVYVOFKNK-UHFFFAOYSA-N

• 3-Hydroxyquinuclidine
IUPAC Name: 1-azabicyclo[2.2.2]octan-8-ol | CAS Registry Number: 1619-34-7
Synonyms: Quinuclidinol, 3-QUINUCLIDINOL, Quinuclidin-3-ol, Quinuclidine-3-ol, 3-Quinuclidinol dl-form, Ambap874, C7H13NO, 136255_ALDRICH, 2-Methyl-4(5)-nitroimidazole, 253340_ALDRICH, 1-Azabicyclo(2.2.2)octan-3-ol, 1-Azabicyclo[2.2.2]octan-3-ol, EINECS 216-578-4, NSC 93905, CID15381, NSC93905, BRN 0104327, SDCCGMLS-0065888.P001, LS-143214, 5-21-01-00271 (Beilstein Handbook Reference)

Molecular Formula: C7H13NOMolecular Weight: 127.184220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IVLICPVPXWEGCA-UHFFFAOYSA-N

• 2-Chloro-5-Trifluoromethylpyridine
IUPAC Name: 2-chloro-5-(trifluoromethyl)pyridine | CAS Registry Number: 52334-81-3
Synonyms: Enamine_005320, 2-Chloro-5-trifluoropyridine, CCRIS 6430, 2-Chloro-5-(trifluoromethyl)pyridine, TPC-PY035, 2-Chloro-5-trifluoromethylpyridine, 366137_ALDRICH, EINECS 257-856-5, Pyridine, 2-chloro-5-(trifluoromethyl)-, BRN 3649688, SBB006728, ZINC02168608, C175, LS-131120

Molecular Formula: C6H3ClF3NMolecular Weight: 181.542930 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JFZJMSDDOOAOIV-UHFFFAOYSA-N


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