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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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• 4-Methyl sulfonyl Benzaldehyde
IUPAC Name: 4-methylsulfonylbenzaldehyde | CAS Registry Number: 5398-77-6
Synonyms: NSC3011, CID220376, SBB005572, ZINC00153759

Molecular Formula: C8H8O3SMolecular Weight: 184.212320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PSVPUHBSBYJSMQ-UHFFFAOYSA-N

• 2,4-Difluoro Benzonitrile
IUPAC Name: 2,4-difluorobenzonitrile | CAS Registry Number: 3939-09-1
Synonyms: 2,4-Difluorobenzonitrile, Benzonitrile, 2,4-difluoro-, 264326_ALDRICH, ZINC00159425, BB_SC-3006, CID77545, JRD-0080, EINECS 223-523-8, 3S210990

Molecular Formula: C7H3F2NMolecular Weight: 139.102226 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LJFDXXUKKMEQKE-UHFFFAOYSA-N

• 2-Bromo-5-fluorotoluene
IUPAC Name: 1-bromo-4-fluoro-2-methylbenzene | CAS Registry Number: 452-63-1
Synonyms: 3-Fluoro-6-bromotoluene, 365009_ALDRICH, NSC88287, EINECS 207-203-5, ZINC00160133, TL806299, ST5405135, InChI=1/C7H6BrF/c1-5-4-6(9)2-3-7(5)8/h2-4H,1H

Molecular Formula: C7H6BrFMolecular Weight: 189.024943 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RJPNVPITBYXBNB-UHFFFAOYSA-N

• 2,4-Difluorobromobenzene
IUPAC Name: 1-bromo-2,4-difluorobenzene | CAS Registry Number: 348-57-2
Synonyms: 1-Bromo-2,4-difluorobenzene, Benzene, 1-bromo-2,4-difluoro-, 1-Bromo-2,4-difluoro-benzene, 263443_ALDRICH, CID67674, JRD-0065, EINECS 206-479-4, TL806164, ST5405337, InChI=1/C6H3BrF2/c7-5-2-1-4(8)3-6(5)9/h1-3

Molecular Formula: C6H3BrF2Molecular Weight: 192.988826 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MGHBDQZXPCTTIH-UHFFFAOYSA-N

• 2-Hydroxycaprylic Acid
IUPAC Name: 2-hydroxyoctanoic acid | CAS Registry Number: 617-73-2
Synonyms: 2-Hydroxyoctanoic acid, alpha-Hydroxycaprylic acid, 2-hydroxy caprylic acid, 2-hydroxy-octanoic acid, 2-Hydroxy-n-caprylic Acid, bmse000572, ()-2-Hydroxycaprylic acid, ()-2-Hydroxyoctanoic acid, .alpha.-Hydroxycaprylic acid, H7396_SIGMA, (+/-)-2-Hydroxycaprylic acid, (+/-)-2-Hydroxyoctanoic acid, CID94180, EINECS 210-524-3, LMFA01050020, NSC189703, NSC 189703, TL8003944

Molecular Formula: C8H16O3Molecular Weight: 160.210840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JKRDADVRIYVCCY-UHFFFAOYSA-N

• 2-Methoxybenzotrifluoride
IUPAC Name: 1-methoxy-2-(trifluoromethyl)benzene | CAS Registry Number: 395-48-2
Synonyms: 2-(Trifluoromethyl)anisole, 1-methoxy-2-(trifluoromethyl)benzene, 2-methoxybenzotrifluoride, 16222-42-7, (trifluoromethyl)anisole, ST50827445, ZINC02512369, PubChem3564, 2-trifluoromethylanisole, AC1MCQ3D, ACMC-209do0, SureCN255270, CTK4D1148, MolPort-001-777-826, 1-methoxy-2-trifluoromethyl-benzene, ANW-21982, SBB089126, 2-methoxy-1-(trifluoromethyl)benzene, AKOS005257892, 1-Methoxy-2-(trifluoromethyl)benzene,

Molecular Formula: C8H7F3OMolecular Weight: 176.135790 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BHPJMWUXVOTGQU-UHFFFAOYSA-N

• 17a-HydroxyProgesterone
IUPAC Name: (8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one | CAS Registry Number: 68-96-2
Synonyms: Prodix, Prodox, Gestageno gador, hydroxyprogesterone, Proluton, Setaderm, Oxiprogesteronum, 17-Hydroxyprogesterone, Gestageno, Idrossiprogesterone [DCIT], 17 Hydroxyprogesterone, 17ALPHA-HYDROXYPROGESTERONE, 17-alpha-Hydroxyprogesterone, 17alpha-Hydroxy-progesterone, HSDB 3343, Hydroxyprogesteronum [INN-Latin], Hidroxiprogesterona [INN-Spanish], 17 alpha Hydroxyprogesterone, 17 alpha-Hydroxyprogesterone, 17-Hydroxypregn-4-ene-3,20-dione

Molecular Formula: C21H30O3Molecular Weight: 330.461100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DBPWSSGDRRHUNT-CEGNMAFCSA-N

• 8-Hydroxyquinoline Copper Salt
IUPAC Name: copper 8-hydroxyquinoline-2-carboxylate | CAS Registry Number: 10380-28-6
Synonyms: Copper 8-hydroxyquinolate

Molecular Formula: C20H12CuN2O6Molecular Weight: 439.865080 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: RQBCOKZWUQNLPR-UHFFFAOYSA-L

• 1-Methyl-4-Nitro-5-Chloro Imidazole
IUPAC Name: 5-chloro-1-methyl-4-nitroimidazole | CAS Registry Number: 4897-25-0
Synonyms: PCMNI, Imidazole, 5-chloro-1-methyl-4-nitro-, MLS001049362, 367532_ALDRICH, 1H-Imidazole, 5-chloro-1-methyl-4-nitro-, 1-Methyl-5-chloro-4-nitroimidazole, EINECS 225-521-2, TOS-BB-0124, ZERO/005727, NSC7852, CID21010, 5-CHLORO-1-METHYL-4-NITROIMIDAZOLE, BRN 0136775, ZINC01081474, 5-Chloro-1-methyl-4-nitro-1H-imidazole, AI3-51948, LS-78292, SMR000427350, S 50154-9, 5-23-04-00493 (Beilstein Handbook Reference)

Molecular Formula: C4H4ClN3O2Molecular Weight: 161.546460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OSJUNMSWBBOTQU-UHFFFAOYSA-N

• 8-Benzyltheophylline
IUPAC Name: 1,3-dimethyl-8-(phenylmethyl)-7H-purine-2,6-dione | CAS Registry Number: 2879-15-4
Synonyms: Theophylline, 8-benzyl-, Oprea1_363271, EINECS 220-725-8, NSC 14131, NSC14131, ZINC01596689, LS-149421, 8-Benzyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-(phenylmethyl)-

Molecular Formula: C14H14N4O2Molecular Weight: 270.286560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: SWKGFZTXWQMFLK-UHFFFAOYSA-N

• 2,6-Dibromo-4-fluoroaniline
IUPAC Name: 2,6-dibromo-4-fluoroaniline | CAS Registry Number: 344-18-3
Synonyms: 340723_ALDRICH, NSC51868, CID242872, ZINC00152805, ST5319394, InChI=1/C6H4Br2FN/c7-4-1-3(9)2-5(8)6(4)10/h1-2H,10H

Molecular Formula: C6H4Br2FNMolecular Weight: 268.909063 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VHPLZFGCNLDYQH-UHFFFAOYSA-N

• 2-Amino-5-Nitrothiazole
IUPAC Name: 5-nitro-1,3-thiazol-2-amine | CAS Registry Number: 121-66-4
Synonyms: Entramin, Enheptin, Enheptin-T, Amnizol soluble, Nitramin IDO, Aminonitrothiazole, Aminzol soluble, Enheptin premix, Enheptin T, Enheptyne, Nitromin ido, Enheptin (VAN), 2-AMINO-5-NITROTHIAZOLE, Aminonitrothiazolum, 2-Thiazolamine, 5-nitro-, Thiazole, 2-amino-5-nitro-, 5-Nitro-2-thiazolylamine, 5-Nitro-2-thiazolamine, 5-Nitro-2-aminothiazole, NSC4

Molecular Formula: C3H3N3O2SMolecular Weight: 145.139820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: MIHADVKEHAFNPG-UHFFFAOYSA-N

• 2-Aminothiophenol
IUPAC Name: 2-aminobenzenethiol | CAS Registry Number: 137-07-5
Synonyms: o-Mercaptoaniline, 2-Mercaptoaniline, o-Aminothiophenol, 2-Mercaptaniline, o-Aminobenzenethiol, Benzenethiol, 2-amino-, 2-AMINOBENZENETHIOL, Benzenethiol, o-amino-, 2-Amino thiophenol, 1-Amino-2-mercaptobenzene, o-Aminophenyl mercaptan, 2-Aminophenyl mercaptan, USAF EK-4376, WLN: ZR BSH, 123137_ALDRICH, 274240_ALDRICH, CCRIS 9096, NSC 4738, EINECS 205-277-3, CID8713

Molecular Formula: C6H7NSMolecular Weight: 125.191480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VRVRGVPWCUEOGV-UHFFFAOYSA-N

• 2,5-Dimethylpyrazine
IUPAC Name: 2,5-dimethylpyrazine | CAS Registry Number: 123-32-0
Synonyms: Pyrazine, 2,5-dimethyl-, 2,5-DIMETHYLPYRAZINE, 2,5-Dimethylpiazine, 2,5-Dimethylparadiazine, 2,5-Dimethyl pyrazine, 2,5-Dimethyl-1,4-diazine, FEMA No. 3272, CCRIS 2929, 2,5-Dimethylpyrazine (natural), W327204_ALDRICH, PYRAZINE,2,5-DIMETHYL, 175420_ALDRICH, 41535_FLUKA, EINECS 204-618-3, WLN: T6N DNJ B1 E1, NSC 49139, NSC49139, ZINC00003182, AI3-60303, LS-2694

Molecular Formula: C6H8N2Molecular Weight: 108.141120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LCZUOKDVTBMCMX-UHFFFAOYSA-N

• 3-Nitro Benzonitrile
IUPAC Name: 3-nitrobenzonitrile | CAS Registry Number: 619-24-9
Synonyms: 3-Nitrobenzonitrile, m-Cyanonitrobenzene, 3-Cyanonitrobenzene, Benzonitrile, m-nitro-, Benzonitrile, 3-nitro-, M-NITROBENZONITRILE, WLN: WNR CCN, CCRIS 2327, 167746_ALDRICH, NSC 5382, EINECS 210-587-7, NSC5382, STK260893, ZINC00164477, AI3-16310, FR-0574, LS-38762, TL8003982, AC-907/25014352, InChI=1/C7H4N2O2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4

Molecular Formula: C7H4N2O2Molecular Weight: 148.118860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: RUSAWEHOGCWOPG-UHFFFAOYSA-N

• 1,3-Dichloroacetone
IUPAC Name: 1,3-dichloropropan-2-one | CAS Registry Number: 534-07-6
Synonyms: s-Dichloroacetone, sym-Dichloroacetone, 1,3-Dichloropropanone, sGQDLHbqBRwSP@, Bis(chloromethyl) ketone, 2-Propanone, 1,3-dichloro-, Bis(chloromethyl)ketone, 1,3-Dichloro-2-propanone, Acetone, 1,3-dichloro, Ambap2889, BISCHLOROMETHYL KETONE, .alpha.,.alpha.'-Dichloroacetone, CCRIS 1942, 1,3-Dichloroacetona [Spanish], 1,3-Dichloroacetone solution, Dichloro-1,3 acetone [French], HSDB 6391, 168548_ALDRICH, NSC 8745, .alpha.,.gamma.-Dichloroacetone

Molecular Formula: C3H4Cl2OMolecular Weight: 126.969260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SUNMBRGCANLOEG-UHFFFAOYSA-N

• 5-MethylUridine (Ribothymidine)
IUPAC Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione | CAS Registry Number: 1463-10-1
Synonyms: Ribothymidine, 5-Methyluridine, Thymine riboside, Ambap220, Uridine, 5-methyl-, nchembio.2007.30-comp3d, 5MU-5MU-5MU, M8905_SIGMA, 535893_ALDRICH, CHEBI:30821, AIDS184529, AIDS-184529, EINECS 215-973-9, ZINC02583634, 5-METHYLURIDINE 5'-MONOPHOSPHATE, TL8001022, 1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione, 1-[(4S,2R,3R,5R)-3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-1,3-dihydropyrimidine-2,4-dione, 5MU, 849658-09-9

Molecular Formula: C10H14N2O6Molecular Weight: 258.227960 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: DWRXFEITVBNRMK-JXOAFFINSA-N

• 2-Chloro-4-fluorotoluene
IUPAC Name: 2-chloro-4-fluoro-1-methylbenzene | CAS Registry Number: 452-73-3
Synonyms: Ambap22, 247693_ALDRICH, Benzene, 2-chloro-4-fluoro-1-methyl-, NSC88317, EINECS 207-209-8, ZINC00164825, C108, TL8003145

Molecular Formula: C7H6ClFMolecular Weight: 144.573943 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CSARJIQZOSVYHA-UHFFFAOYSA-N

• 16-Dehydro-Pregnenolone
IUPAC Name: 1-[(3S,8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone | CAS Registry Number: 1162-53-4
Synonyms: 16-Dehydropregnenolone, 16-Dehydropregnolone, delta16-Pregnenolone, Delta(16)-pregnenolone, .DELTA.16-Pregnenolone, 16,17-Didehydropregnenolone, CHEBI:27486, BB_NC-0066, NSC15467, EINECS 214-602-8, 3beta-Hydroxypregna-5,16-dien-20-one, 5,16-Pregnadien-3beta-ol-20-one, NSC 15467, ZINC02122287, 3-beta-Hydroxypregna-5,16-dien-20-one, (3beta)-3-hydroxypregna-5,16-dien-20-one, Pregna-5,16-dien-20-one, 3.beta.-hydroxy-, Pregna-5,16-dien-20-one, 3beta-hydroxy- (8CI), Pregna-5,16-dien-20-one, 3-hydroxy-, (3.beta.)-, Pregna-5,16-dien-20-one, 3-hydroxy-, (3beta)- (9CI)

Molecular Formula: C21H30O2Molecular Weight: 314.461700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YLFRRPUBVUAHSR-RRPFGEQOSA-N

• 2-Benzyl Chloride Fluoride
IUPAC Name: 1-(chloromethyl)-3-fluorobenzene | CAS Registry Number: 456-42-8
Synonyms: 3-Fluorobenzyl chloride, 3-Fluorobenzylchloride, M-FLUOROBENZYL CHLORIDE, alpha-Chloro-3-fluorotoluene, alpha-Chloro-m-fluorotoluene, F7806_ALDRICH, Benzene, 1-(chloromethyl)-3-fluoro-, Toluene, .alpha.-chloro-m-fluoro-, .alpha.-Chloro-m-fluorotoluene, 1-(Chloromethyl)-3-fluorobenzene, 1-Chloromethyl-3-fluorobenzene, .alpha.-Chloro-3-fluorotoluene, 46821_FLUKA, CID9974, NSC60720, EINECS 207-264-8, NSC 60720, ZINC00164512, Toluene, alpha-chloro-m-fluoro- (8CI), F118

Molecular Formula: C7H6ClFMolecular Weight: 144.573943 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XBDXMDVEZLOGMC-UHFFFAOYSA-N

• 3,4-Diethoxybenzoic Acid Ethyl Ester
IUPAC Name: ethyl 3,4-diethoxybenzoate | CAS Registry Number: 75332-44-4
Synonyms: Ethyl 3,4-diethoxybenzoate, 3,4-Diethoxybenzoic acid ethyl ester, AC1LBOSW, ACMC-1BE5K, SureCN1011945, Ambap75332-44-4, AC1Q64H4, CTK5E1439, AR-1I8701, ZINC00403445, AKOS005834453, AG-B-64163, AG-J-41716, Benzoic acid,3,4-diethoxy-, ethyl ester, Benzoic acid, 3,4-diethoxy-, ethyl ester, KB-252866, FT-0614267, I01-18388, 3,4-Diethoxybenzoicacid ethyl ester; Ethyl 3,4-diethoxybenzoate

Molecular Formula: C13H18O4Molecular Weight: 238.279620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: UWWIFSJMLYCVGX-UHFFFAOYSA-N

• 3-Methylthiohexanol
IUPAC Name: 3-methylsulfanylhexan-1-ol | CAS Registry Number: 51755-66-9
Synonyms: 3-(Methylthio)hexanol, 3-(methylthio) hexanol, 3-(Methylthio)-1-hexanol, 3-(Methylthio)-hexan-1-ol, 3-(Methylthio)hexan-1-ol, W343803_ALDRICH, 1-Hexanol, 3-(methylthio)-, 3-(Methylmercapto)-1-hexanol, FEMA No. 3438, 303747_ALDRICH, EINECS 257-380-8, AI3-37114

Molecular Formula: C7H16OSMolecular Weight: 148.266340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JSASXSHMJYRPCM-UHFFFAOYSA-N

• 2,5-Dihydroxybenzoic Acid
IUPAC Name: 2,5-dihydroxybenzoic acid | CAS Registry Number: 490-79-9
Synonyms: gentisic acid, Gentisate, Gensigen, Gensigon, Gentinatre, Hydroquinonecarboxylic acid, Gentalpin, Gentasol, Gentidol, Gentisan, Gentisod, Legential, Nagentis, Casate, Gabail, Nagent, 5-Hydroxysalicylic acid, Gentisinic acid, Casate sodium, Gensalate sodium

Molecular Formula: C7H6O4Molecular Weight: 154.120140 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: WXTMDXOMEHJXQO-UHFFFAOYSA-N

• 2-Aminopyridine
IUPAC Name: pyridin-2-amine | CAS Registry Number: 504-29-0
Synonyms: 2-Pyridinamine, 2-AMINOPYRIDINE, 2-Pyridylamine, o-Aminopyridine, 2-Aminopryidine, Aminopyridine, Pyridinamine, pyridin-2-amine, alpha-Pyridinamine, alpha-Pyridylamine, Amino-2 pyridine, Pyridine, amino-, 2-Pyridinylnitrene, alpha-Aminopyridine, 2-pyridinylamine, Pyridine, 2-amino-, .beta.-Pyridylamine, .alpha.-Pyridinamine, .alpha.-Pyridylamine, Pyridinamine (9CI)

Molecular Formula: C5H6N2Molecular Weight: 94.114540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ICSNLGPSRYBMBD-UHFFFAOYSA-N

• 2-(3-Amino-4-Chlorobenyzoyl)-Benzoic Acid
IUPAC Name: 2-(3-amino-4-chlorobenzoyl)benzoic acid | CAS Registry Number: 118-04-7
Synonyms: Oprea1_159790, NSC74496, CID67037, EINECS 204-230-4, NSC 74496, o-(3-Amino-4-chlorobenzoyl)benzoic acid, Benzoic acid, 2-(3-amino-4-chlorobenzoyl)-, Benzoic acid, o-(3-amino-4-chlorobenzoyl)-, 2-(3-Amino-4-chlorobenzoyl)benzoic acid, 2-(3-Amino-4-chloro-benzoyl)benzoic acid, ST5146741, TL8000498, Benzoic acid, o-(3-amino-4-chlorobenzoyl)- (8CI)

Molecular Formula: C14H10ClNO3Molecular Weight: 275.687100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: MQECGSWGDQIHHD-UHFFFAOYSA-N

• 1-(2,6-Dichlorophenyl)-2-Indolinone
IUPAC Name: 1-(2,6-dichlorophenyl)-3H-indol-2-one | CAS Registry Number: 15362-40-0
Synonyms: ChemDiv3_002423, MLS000527383, EINECS 239-399-3, 1-(2,6-Dichlorophenyl)indolin-2-one, BRN 1538309, NSC621845, ZINC00170657, BAS 01026882, LS-83776, NCI60_006351, SMR000117857, 1-(2,6-Dichloro-phenyl)-1,3-dihydro-indol-2-one, 1,3-Dihydro-1-(2,6-dichlorophenyl)-2H-indol-2-one, 1-(2,6-Dichlorophenyl)-1,3-dihydro-2H-indol-2-one, 2H-INDOL-2-ONE, 1,3-DIHYDRO-1-(2,6-DICHLOROPHENYL)-, A2202/0092681, 2H-Indol-2-one, 1-(2,6-dichlorophenyl)-1,3-dihydro-

Molecular Formula: C14H9Cl2NOMolecular Weight: 278.133360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JCICIFOYVSPMHG-UHFFFAOYSA-N

• 5-Bromo-2-fluorobenzotrifluoride
IUPAC Name: 4-bromo-1-fluoro-2-(trifluoromethyl)benzene | CAS Registry Number: 393-37-3
Synonyms: 549096_ALDRICH, JRD-0414, 4-Fluoro-3-(trifluoromethyl)bromobenzene, ST5408581, TL8002840, 4-bromo-1-fluoro-2-(trifluoromethyl)benzene

Molecular Formula: C7H3BrF4Molecular Weight: 242.996333 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: AJLIJYGWAXPEOK-UHFFFAOYSA-N

• 2-Hydroxy-2-Mercaptopyrimidine
IUPAC Name: 2-sulfanylidene-1H-pyrimidin-4-one | CAS Registry Number: 141-90-2
Synonyms: 2-thiouracil, Antagothyroid, Thiouracil, Antagothyroil, Deracil, Nobilen, 6-Thiouracil, Uracil, 2-thio-, Tiouracyl [Polish], 2-Mercapto-4-pyrimidone, 2-Thiouracil (VAN), 2-Mercapto-4-pyrimidinol, 2-Thio-4-oxypyrimidine, 2-Thio-6-oxypyrimidine, 4-Hydroxy-2-pyrimidinethiol, 4-Hydroxy-2-mercaptopyrimidine, Ambap4491, Spectrum_001652, 4-Pyrimidinol, 2-mercapto-, SpecPlus_000746

Molecular Formula: C4H4N2OSMolecular Weight: 128.152360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: ZEMGGZBWXRYJHK-UHFFFAOYSA-N

• 2-Chlorophenothiazine
IUPAC Name: 2-chloro-10H-phenothiazine | CAS Registry Number: 92-39-7
Synonyms: 2-Chloro-10H-phenothiazine, 10H-Phenothiazine, 2-chloro-, 2-Chlorothiodiphenylamine, 2-CHLOROPHENOTHIZINE, PHENOTHIAZINE, 2-CHLORO-, Oprea1_205445, C63006_ALDRICH, NSC17469, 26495_FLUKA, EINECS 202-152-5, NSC 17469, AIDS031695, NSC 170953, WLN: T C666 BM ISJ EG, AIDS-031695, NSC67188, NSC170953, SBB003255, ZINC00035809, LS-105338

Molecular Formula: C12H8ClNSMolecular Weight: 233.716620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KFZGLJSYQXZIGP-UHFFFAOYSA-N

• 1,2-Chloroethyl Piperidine HCl
IUPAC Name: 1-(2-chloroethyl)piperidine hydrochloride | CAS Registry Number: 2008-75-5
Synonyms: Ambap7519, C42602_ALDRICH, Piperidinoethyl chloride, hydrochloride, NSC 9995, EINECS 217-920-5, NSC9995, NSC 30790, 1-(2-Chloroethyl)piperidine hydrochloride, 1-(2-Chloroethyl)piperidinium chloride, beta-Chloroethylpiperidine hydrochloride, CID74826, NSC30790, 2-Piperidinoethylchloride hydrochloride, Piperidine, 1-(2-chloroethyl)-, hydrochloride, 2-Piperidinoethyl chloride hydrochloride, N-(beta-CHLOROETHYL)PIPERIDINE HCI, LS-114795, TL8001656

Molecular Formula: C7H15Cl2NMolecular Weight: 184.106700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VFLQQZCRHPIGJU-UHFFFAOYSA-N

• 3-Nitro-4-Chloro-5-Sulfamoyl Benzoic Acid
IUPAC Name: 4-chloro-3-nitro-5-sulfamoylbenzoic acid | CAS Registry Number: 22892-96-2
Synonyms: EINECS 245-310-9, SBB003020, 4-Chloro-3-nitro-5-sulphamoylbenzoic acid, LS-36036

Molecular Formula: C7H5ClN2O6SMolecular Weight: 280.642400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: ACYLUAGCBGTEJF-UHFFFAOYSA-N

• 2(3,5-Dihydroxy) Benzoic Acid
IUPAC Name: 3,5-dihydroxybenzoic acid | CAS Registry Number: 99-10-5
Synonyms: alpha-Resorcylic acid, 5-Carboxyresorcinol, 3,5-DIHYDROXYBENZOIC ACID, .alpha.-Resorcylic acid, Benzoic acid, 3,5-dihydroxy-, Ambap1483, 3,5-DIHYDROXYBENZOATE, D110000_ALDRICH, EINECS 202-730-7, NSC 22948, AIDS018063, AIDS-018063, NSC22948, BRN 2207864, AI3-52338, LS-143431, TL8006060, 4-10-00-01501 (Beilstein Handbook Reference), 34D, InChI=1/C7H6O4/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,8-9H,(H,10,11

Molecular Formula: C7H6O4Molecular Weight: 154.120140 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: UYEMGAFJOZZIFP-UHFFFAOYSA-N

• 4-(Trifluoromethoxy)benzaldehyde
IUPAC Name: 4-(trifluoromethoxy)benzaldehyde | CAS Registry Number: 659-28-9
Synonyms: Ambap2060, 4-Trifluoromethoxy-benzaldehyde, 370606_ALDRICH, p-(Trifluoromethoxy)benzaldehyde, Benzaldehyde, 4-(trifluoromethoxy)-, JRD-0132, EINECS 211-531-4, ZINC00165235, alpha,alpha,alpha-Trifluoroanisaldehyde, TL8004676

Molecular Formula: C8H5F3O2Molecular Weight: 190.119310 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: XQNVDQZWOBPLQZ-UHFFFAOYSA-N

• 2,6-Xylidine
IUPAC Name: 2,6-dimethylaniline | CAS Registry Number: 87-62-7
Synonyms: 2,6-Dimethylaniline, o-Xylidine, 2,6-XYLIDINE, 2-Amino-m-xylene, Xylylamine, 2,6-Xylylamine, o-Xylidine (VAN), Benzenamine, 2,6-dimethyl-, 2-Amino-1,3-xylene, 2,6-Dimethylbenzenamine, Aniline, 2,6-dimethyl-, 2,6-Dimethylphenylamine, 2-Amino-1,3-dimethylbenzene, 1-Amino-2,6-dimethylbenzene, 2,6-xylidine hydrochloride, CCRIS 2373, 2,6-xylidine, 3H-labeled, NCI-C56188, HSDB 2094, D146005_ALDRICH

Molecular Formula: C8H11NMolecular Weight: 121.179640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UFFBMTHBGFGIHF-UHFFFAOYSA-N

• 5-Chloro-2-nitrobenzotrifluoride
IUPAC Name: 4-chloro-1-nitro-2-(trifluoromethyl)benzene | CAS Registry Number: 118-83-2
Synonyms: C60805_ALDRICH, EINECS 204-280-7, SBB009905, ZINC00057136, 4-Chloro-1-nitro-2-(trifluoromethyl)benzene, Benzene, 4-chloro-1-nitro-2-(trifluoromethyl)-, 5-Chloro-2-nitro-alpha,alpha,alpha-trifluorotoluene, 5-Chloro-alpha,alpha,alpha-trifluoro-2-nitrotoluene, T5652305

Molecular Formula: C7H3ClF3NO2Molecular Weight: 225.552430 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: CFPIGEXZPWTNOR-UHFFFAOYSA-N

• 3,4,5-Trimethoxybenzaldehyde (TMBA)
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-Quinuclidinone Hydrochloride
IUPAC Name: 1-azabicyclo[2.2.2]octan-3-one hydrochloride | CAS Registry Number: 1193-65-3
Synonyms: Ambap2256, 3-Quinuclidone hydrochloride, Q1905_ALDRICH, 3-QUINUCLIDINONE HCL, 3-Quinuclidinone hydrochloride, Quinuclidin-3-one hydrochloride, EINECS 214-776-5, NSC 91498, ST5307926, 1-Azabicyclo[2.2.2]octan-3-one hydrochloride, 1-Azabicyclo(2.2.2)octan-3-one, hydrochloride, 139086-75-2

Molecular Formula: C7H12ClNOMolecular Weight: 161.629280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RFDPHKHXPMDJJD-UHFFFAOYSA-N

• 2-Aminobenzophenone
IUPAC Name: (2-aminophenyl)-phenylmethanone | CAS Registry Number: 2835-77-0
Synonyms: o-Benzoylaniline, 2-Benzoylaniline, o-Aminobenzophenone, Benzophenone, 2-amino-, 2-Aminophenyl phenyl ketone, Oprea1_344183, Oprea1_386897, A41208_ALDRICH, MLS000103987, ARONIS021120, IFLab1_000932, Methanone, (2-aminophenyl)phenyl-, Benzophenone, 2-amino- (8CI), (2-aminophenyl)(phenyl)methanone, NSC9422, NSC 9422, EINECS 220-613-9, SBB003573, ZINC00143376, SMR000015734

Molecular Formula: C13H11NOMolecular Weight: 197.232540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MAOBFOXLCJIFLV-UHFFFAOYSA-N

• 2-Nitrobenzyl Alcohol
IUPAC Name: (2-nitrophenyl)methanol | CAS Registry Number: 612-25-9
Synonyms: 2-Nitrobenzyl alcohol, Benzyl alcohol, o-nitro-, Benzenemethanol, 2-nitro-, 2-Nitrobenzenemethanol, o-Hydroxymethylnitrobenzene, O-NITROBENZYL ALCOHOL, Ambap7338, (2-Nitrophenyl)methanol, CCRIS 7967, NCIOpen2_000032, N12805_ALDRICH, EINECS 210-302-6, NSC 66512, Benzenemethanol, 2-nitro- (9CI), NSC66512, BRN 2046649, ZINC00157463, AI3-16131, LS-43118, 4-06-00-02608 (Beilstein Handbook Reference)

Molecular Formula: C7H7NO3Molecular Weight: 153.135380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BWRBVBFLFQKBPT-UHFFFAOYSA-N

• 2,2'-Dithiosalicylic Acid
IUPAC Name: 2-(2-carboxyphenyl)disulfanylbenzoic acid | CAS Registry Number: 119-80-2
Synonyms: Dithiosalicylic acid, 2,2'-Dithiodibenzoic acid, Bis(2-carboxyphenyl) disulfide, 2-Carboxyphenyl disulfide, Bis(o-carboxylphenyl) disulfide, Disulfide benzamide analog, Benzoic acid, 2,2'-dithiobis-, Bis(o-carboxyphenyl) disulfide, 2,2'-Dithiodi(benzoic acid), 2,2'-Dithiosalicylic acid, NSC213, 2,2'-Dithiobis(benzoic acid), MLS001216615, NSC 213, NSC5346, 2,2'-Dithiobis[benzoic acid], 389285_ALDRICH, NSC 5346, 43761_FLUKA, BENZOIC ACID, 2,2'-DITHIODI-

Molecular Formula: C14H10O4S2Molecular Weight: 306.356800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: LBEMXJWGHIEXRA-UHFFFAOYSA-N

• 2,3-Pyrazine Dicarboxylic Acid
IUPAC Name: pyrazine-2,3-dicarboxylic acid | CAS Registry Number: 89-01-0
Synonyms: 2,3-Pyrazinedicarboxylic acid, 2,3-Dicarboxypyrazine, Pyrazine-2,3-dicarboxylate, Pyrazine-2,3-dicarboxylic acid, Maybridge1_001780, P56208_ALDRICH, NSC1908, NSC 1908, EINECS 201-875-3, AIDS012682, AIDS-012682, BRN 0147982, NCI60_001592, LS-127602, ST5160363, TL8005761, P-8100, 5-25-05-00383 (Beilstein Handbook Reference), SR-01000635503-1

Molecular Formula: C6H4N2O4Molecular Weight: 168.106960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: ZUCRGHABDDWQPY-UHFFFAOYSA-N

• 2,7-Dihydroxy Naphthalene
IUPAC Name: naphthalene-2,7-diol | CAS Registry Number: 582-17-2
Synonyms: 2,7-Naphthalenediol, Naphthalene-2,7-diol, 2,7-DIHYDROXYNAPHTHALENE, CI 76645, Naphthalenediol-2,7 [French], D116408_ALDRICH, NSC 407541, 37781_FLUKA, EINECS 209-478-7, AIDS017777, 2,7-Naphthalenediol (8CI,9CI), C.I. 76645, AIDS-017777, BRN 2042383, NSC407541, ZINC00388554, LS-94572, ST5406389, 4-06-00-06570 (Beilstein Handbook Reference)

Molecular Formula: C10H8O2Molecular Weight: 160.169320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: DFQICHCWIIJABH-UHFFFAOYSA-N

• 3-Bromo-4-chlorobenzotrifluoride
IUPAC Name: 2-bromo-1-chloro-4-(trifluoromethyl)benzene | CAS Registry Number: 454-78-4
Synonyms: 365750_ALDRICH, NSC59728, CID67988, EINECS 207-226-0, 2-Bromo-1-chloro-4-(trifluoromethyl)benzene, ST5406127, Benzene, 2-bromo-1-chloro-4-(trifluoromethyl)-, 3-Bromo-4-chloro-alpha,alpha,alpha-trifluorotoluene

Molecular Formula: C7H3BrClF3Molecular Weight: 259.450930 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: APSISOSWYXCEQX-UHFFFAOYSA-N

• 4-Bromophenol
IUPAC Name: 4-bromophenol | CAS Registry Number: 106-41-2
Synonyms: p-Bromophenol, 4-BROMOPHENOL, Phenol, 4-bromo-, Phenol, p-bromo-, p-Bromophenic acid, p-Bromohydroxybenzene, CCRIS 632, B75808_ALDRICH, 442405_SUPELCO, NSC 4970, EINECS 203-394-4, NSC4970, AIDS017751, AIDS-017751, ZINC00404316, AI3-14903, TL806339, LS-104088, ST5214520, C14453

Molecular Formula: C6H5BrOMolecular Weight: 173.007300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GZFGOTFRPZRKDS-UHFFFAOYSA-N

• 2-Fluorobenzoyl Chloride
IUPAC Name: 2-fluorobenzoyl chloride | CAS Registry Number: 393-52-2
Synonyms: o-Fluorobenzoyl chloride, 2-FLUOROBENZOYL CHLORIDE, Benzoyl chloride, 2-fluoro-, Benzoyl chloride, o-fluoro-, WLN: GVR BF, CCRIS 5914, HSDB 4261, 120847_ALDRICH, 46740_FLUKA, EINECS 206-887-2, NSC 88304, NSC88304, BRN 0636864, LS-107, ZINC02022413, NCGC00091418-01, F157, ST5214060, TL8002844, 4-09-00-00951 (Beilstein Handbook Reference)

Molecular Formula: C7H4ClFOMolecular Weight: 158.557463 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RAAGZOYMEQDCTD-UHFFFAOYSA-N

• 2-Bromo-6-Methoxy Naphthalene
IUPAC Name: 2-bromo-6-methoxynaphthalene | CAS Registry Number: 5111-65-9
Synonyms: 2-Bromo-6-methoxynaphthalene, Naphthalene, 2-bromo-6-methoxy-, 6-Methoxy-2-bromonaphthalene, 6-Bromo-2-naphthylmethylether, NSC3236, 200174_ALDRICH, 17540_FLUKA, CID78786, NSC 3236, EINECS 225-837-0, ZINC00164677, AI3-18465, ST5308358, InChI=1/C11H9BrO/c1-13-11-5-3-8-6-10(12)4-2-9(8)7-11/h2-7H,1H

Molecular Formula: C11H9BrOMolecular Weight: 237.092560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: AYFJBMBVXWNYLT-UHFFFAOYSA-N

• 4-Bromo Thioanisole
IUPAC Name: 1-bromo-4-methylsulfanylbenzene | CAS Registry Number: 104-95-0
Synonyms: 4-Bromothioanisole, p-Bromo(methylthio)benzene, Methyl 4-bromophenylsulfide, p-Bromophenyl methyl sulfide, Maybridge1_001085, p-BROMO THIOANISOLE, Benzene, 1-bromo-4-(methylthio)-, 1-Bromo-4-(methylthio)benzene, 4-Bromophenyl methyl sulfide, 4-Bromophenyl methyl sulphide, Sulfide, p-bromophenyl methyl, 196525_ALDRICH, 1-bromo-4-methylsulfanylbenzene, NSC73383, EINECS 203-255-8, NSC 73383, ZINC00167168, Sulfide, p-bromophenyl methyl (8CI), TL806410, ST5308312

Molecular Formula: C7H7BrSMolecular Weight: 203.099480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: YEUYZNNBXLMFCW-UHFFFAOYSA-N

• 2,3,4-Trifluoronitrobenzene
IUPAC Name: 1,2,3-trifluoro-4-nitrobenzene | CAS Registry Number: 771-69-7
Synonyms: Ambap5910, 1,2,3-Trifluoro-4-nitrobenzene, 338362_ALDRICH, 4-Nitro-1,2,3-trifluorobenzene, ZINC01845704, CID69871, EINECS 212-238-4, Benzene, 1,2,3-trifluoro-4-nitro-, T135

Molecular Formula: C6H2F3NO2Molecular Weight: 177.080790 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: ARCACZWMYGILNI-UHFFFAOYSA-N

• 2,4-Difluorobenzyl bromide
IUPAC Name: 1-(bromomethyl)-2,4-difluorobenzene | CAS Registry Number: 23915-07-3
Synonyms: 264415_ALDRICH, alpha-Bromo-2,4-difluorotoluene, .alpha.-Bromo-2,4-difluorotoluene, CID90297, JRD-0043, EINECS 245-938-3, SBB006567, 1-(Bromomethyl)-2,4-difluorobenzene, TL8001977

Molecular Formula: C7H5BrF2Molecular Weight: 207.015406 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IBLMYGXJKQIGSN-UHFFFAOYSA-N

• 2,7-Dimethoxy Naphthalene
IUPAC Name: 2,7-dimethoxynaphthalene | CAS Registry Number: 3469-26-9
Synonyms: 2,7-Dimethoxynaphthalene, Naphthalene, 2,7-dimethoxy-, 213152_ALDRICH, 2,7-DIMETHOXY NAPHTHALENE, NSC28991, EINECS 222-433-6, ZINC00407015, ST5406515

Molecular Formula: C12H12O2Molecular Weight: 188.222480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PPKHAIRFQKFMLE-UHFFFAOYSA-N


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