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Shanghai Zealing Chemical Co., Ltd.

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Profile: Shanghai Zealing Chemical Co., Ltd. is engaged in advanced chemical intermediates for the pharmaceutical/biotech industry, either by custom synthesis or by contract.

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• 5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
IUPAC Name: 5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid | CAS Registry Number: 253870-02-9
Synonyms: 5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic Acid, 5-FORMYL-2,4-DIMETHYLPYRROLE-3-CARBOXYLIC ACID, 3,5-Dimethyl-2-formylpyrrole-4-carboxylic acid, 2,4-dimethyl-5-formylpyrrole-3-carboxylic acid, 5-Formyl-2,4-dimethyl-1H-pyrrole-3-carboxylicacid, 3,5-dimethyl-2-formyl-1h-pyrrole-4-carboxylic acid, SBB053097, 3,5-dimethyl-2-formylindole-4-carboxylic acid, 1H-PYRROLE-3-CARBOXYLIC ACID, 5-FORMYL-2,4-DIMETHYL-, zlchem 714, PubChem9414, ACMC-209zxq, KSC201S7B, Jsp005037, CTK1A1970, ZLD0167, MolPort-001-770-972, ACN-S003126, ACT01686, ANW-50844

Molecular Formula: C8H9NO3Molecular Weight: 167.161960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: YCIHQDVIAISDPS-UHFFFAOYSA-N

• 4(3H)-Pyrimidone
IUPAC Name: 5H-pyrimidin-4-one | CAS Registry Number: 51953-17-4
Synonyms: 4-Hydroxypyrimidine, 3H-Pyrimidin-4-one, EINECS 257-545-4, CID104028

Molecular Formula: C4H4N2OMolecular Weight: 96.087360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: TZYQTWHRLVDYPL-UHFFFAOYSA-N

• 4-Aminopyrimidine
IUPAC Name: pyrimidin-4-amine | CAS Registry Number: 591-54-8
Synonyms: 4-Pyrimidinamine, pyrimidin-4-amine, Pyrimidine, 4-amino-, 4-Pyrimidineamine, 6-Aminopyrimidine, Pyrimidin-4-ylamine, 4-Pyrimidinamine (9CI), WLN: T6N CNJ DZ, 261823_ALDRICH, CHEBI:38616, NSC401236, ZINC01593930, NSC 401236, PB316171728, InChI=1/C4H5N3/c5-4-1-2-6-3-7-4/h1-3H,(H2,5,6,7

Molecular Formula: C4H5N3Molecular Weight: 95.102600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OYRRZWATULMEPF-UHFFFAOYSA-N

• 3-Nitrophenethyl alcohol
IUPAC Name: 2-(3-nitrophenyl)ethanol | CAS Registry Number: 52022-77-2
Synonyms: Benzeneethanol, 3-nitro-, 3-Nitrobenzeneethanol, m-Nitrophenethyl alcohol, .beta.-(m-Nitrophenyl)ethanol, 281794_ALDRICH, EINECS 257-611-2, SBB008558, InChI=1/C8H9NO3/c10-5-4-7-2-1-3-8(6-7)9(11)12/h1-3,6,10H,4-5H

Molecular Formula: C8H9NO3Molecular Weight: 167.161960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PWZWTSYUZQZFKE-UHFFFAOYSA-N

• 3-Bromo-3-buten-1-ol
IUPAC Name: 3-bromobut-3-en-1-ol | CAS Registry Number: 76334-36-6
Synonyms: 3-BROMOBUT-3-EN-1-OL, 410888_ALDRICH, 16501_FLUKA, CID533975, ZINC02530726, DB04592, 3BB

Molecular Formula: C4H7BrOMolecular Weight: 151.001780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: RTKMFQOHBDVEBC-UHFFFAOYSA-N

• 4-Fluorosalicylic acid
IUPAC Name: 4-fluoro-2-hydroxybenzoic acid | CAS Registry Number: 345-29-9
Synonyms: Ambap5213, 554332_ALDRICH, EINECS 206-459-5, NSC109099, TL8002573

Molecular Formula: C7H5FO3Molecular Weight: 156.111203 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: TTZOLDXHOCCNMF-UHFFFAOYSA-N

• 4-Iodo-3-methylpyrazole
IUPAC Name: 4-iodo-5-methyl-1H-pyrazole | CAS Registry Number: 15802-75-2
Synonyms: 3-Methyl-4-iodopyrazole, 4-Iodo-3-methyl-1H-pyrazole, 4-lodo-3-methylpyrazole, 4-Iodo-3-methyl pyrazole, AG-E-07145, zlchem 130, PubChem12661, 4-iodo-3-methylpyrazole, ACMC-1C4EJ, AGN-PC-00PGNO, SureCN1358702, SureCN1359021, KSC174G6B, 4-iodo-3-methyl-2H-pyrazole, 4-iodo-5-methyl-1H-pyrazole, Jsp003128, CTK0H4360, ZLB0119, MolPort-003-986-489, MolPort-008-154-379

Molecular Formula: C4H5IN2Molecular Weight: 208.000370 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SHDMYGCRVXWTGR-UHFFFAOYSA-N

• 3-Bromoindazole
IUPAC Name: 3-bromo-2H-indazole | CAS Registry Number: 40598-94-5
Synonyms: 3-bromo-1H-indazole, 3-brom-1h-indazol, 1H-Indazole, 3-bromo-, bromoindazole, AG-F-44123, ZINC04037279, zlchem 586, 3-bromo-2H-indazole, PubChem11861, 3-Bromo-1H-indazole;, AC1LF1RC, SureCN61457, ACMC-1AMC6, INDAZOLE, 3-BROMO-, MLS000097926, AC1Q25K3, CTK1D5634, ZLD0031, MolPort-000-001-820, HMS1755L10

Molecular Formula: C7H5BrN2Molecular Weight: 197.032000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HTKXRTUKPXEALT-UHFFFAOYSA-N

• 5-Bromo-2-Chloroanisole
IUPAC Name: 4-bromo-1-chloro-2-methoxybenzene | CAS Registry Number: 16817-43-9
Synonyms: 5-Bromo-2-chloroanisole, 4-Bromo-1-chloro-2-methoxybenzene, 5-Bromo-2-chloroanisol, 4-chloro-3-methoxybromobenzene, ZINC00403364, zlchem 582, PubChem2632, ACMC-209dxq, AC1MCH6V, 2-Chloro-5-bromoanisole, 5-Bromo-2-chloroanisole,, SureCN263669, KSC497I0B, 516767_ALDRICH, Jsp003403, CTK3J7400, ZLD0026, MolPort-001-757-184, ACT00201, ANW-22332

Molecular Formula: C7H6BrClOMolecular Weight: 221.478940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: UAMVKOTWSHJOSY-UHFFFAOYSA-N

• 1,3,(6 or 7)-Naphthalene Trisulfonic Acid
IUPAC Name: trisodium;naphthalene-2,3,6-trisulfonate;hydrate | CAS Registry Number: 123409-01-8
Synonyms: 1,3,(6,7)-Naphthalenetrisulfonic acid trisodium salt hydrate, zlchem 597, ZLD0044, ACT05822, ST51056502, trisodium naphthalene-2,3,6-trisulfonate hydrate, A805068, S14-0658

Molecular Formula: C10H7Na3O10S3Molecular Weight: 452.320888 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 10

InChIKey: IQIJZMTUEVJELZ-UHFFFAOYSA-K

• 4-Pyridinecarboxaldehyde
IUPAC Name: pyridine-4-carbaldehyde | CAS Registry Number: 872-85-5
Synonyms: Isonicotinaldehyde, p-Pyridinealdehyde, 4-Pyridinealdehyde, Isonicotinic aldehyde, 4-Pyridylaldehyde, p-Formylpyridine, Pyridine-4-carbaldehyde, 4-FORMYLPYRIDINE, Pyridin-4-al, gamma-Formylpyridine, Pyridine-4-carboxaldehyde, Pyridine-4-ylcarboxaldehyde, P62402_ALDRICH, NSC 8953, EINECS 212-832-3, NSC8953, c1163, SBB004357, ZINC00157163, AI3-33232

Molecular Formula: C6H5NOMolecular Weight: 107.110000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BGUWFUQJCDRPTL-UHFFFAOYSA-N

• 2,4-Dihydroxy Benzyl Alcohol
IUPAC Name: 4-(hydroxymethyl)benzene-1,3-diol | CAS Registry Number: 33617-59-3
Synonyms: 4-(Hydroxymethyl)resorcinol, 2,4-Dihydroxybenzyl alcohol, EINECS 251-597-1, 1,3-Benzenediol, 4-(hydroxymethyl)-

Molecular Formula: C7H8O3Molecular Weight: 140.136620 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: RQCDKJFKYGNXBD-UHFFFAOYSA-N

• 4,5-Dimethylbenzene-1,2-Dimethanol
IUPAC Name: [2-(hydroxymethyl)-4,5-dimethylphenyl]methanol | CAS Registry Number: 60070-05-5
Synonyms: ZINC02566747, CID7020684, LT03381787

Molecular Formula: C10H14O2Molecular Weight: 166.216960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VSODREOTHFONSP-UHFFFAOYSA-N

• 2-(3-bromophenyl)-1-phenyl-1H-benzimidazole
IUPAC Name: 2-(3-bromophenyl)-1-phenylbenzimidazole | CAS Registry Number: 760212-40-6
Synonyms: 2-(3-Bromophenyl)-1-phenyl-1H-benzimidazole, 2-(3-Bromophenyl)-1-phenyl-1H-benzoimidazole, AG-H-03283, 2-(3-bromophenyl)-1-phenyl-1H-benzo[d]imidazole, zlchem 648, SureCN338639, CTK5E2392, ZLD0098, MolPort-020-001-061, ACT05939, ANW-66401, ZINC49588495, AKOS015901373, LS40629, 2-(3-bromophenyl)-1-phenylbenzimidazole, AK-50102, KB-14350, 2-(3-bromophenyl)-1-phenyl-benzimidazole, FT-0656594, ST51055557

Molecular Formula: C19H13BrN2Molecular Weight: 349.223920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YFUWVSPCUFTGQN-UHFFFAOYSA-N

• 9-Aminopelargonic Acid
IUPAC Name: 9-aminononanoic acid | CAS Registry Number: 1120-12-3
Synonyms: 9-Aminononanoic acid, AmbTiA30200, MolPort-000-000-344, CID136877, LMFA01100010, A30200

Molecular Formula: C9H19NO2Molecular Weight: 173.252660 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: VWPQCOZMXULHDM-UHFFFAOYSA-N

• 3-Phenyl-2-(phenylsulfonyl)-1,2-oxaziridine
IUPAC Name: (3R)-2-(benzenesulfonyl)-3-phenyloxaziridine | CAS Registry Number: 63160-13-4
Synonyms: NSC377129, ZINC05662570, CID10923301, trans-2-(Phenylsulfonyl)-3-phenyloxyaziridine

Molecular Formula: C13H11NO3SMolecular Weight: 261.296340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: MKHGVMIXRPGHOO-KWCCSABGSA-N

• 2-Amino-4,6-Dichloro Pyrimidine
IUPAC Name: 4,6-dichloropyrimidin-2-amine | CAS Registry Number: 56-05-3
Synonyms: 2-Amino-4,6-dichloropyrimidine, Py 11, 2-Pyrimidinamine, 4,6-dichloro-, CCRIS 7460, 4,6-Dichloro-2-pyrimidinamine, A48601_ALDRICH, 4,6-Dichloropyrimidin-2-ylamine, Pyrimidine, 2-amino-4,6-dichloro-, 07686_FLUKA, EINECS 200-253-9, NSC 18698, AIDS020791, AIDS-020791, NSC18698, BRN 0118454, SBB003919, ZINC01081248, AI3-52142, LS-134474, Pyrimidine, 2-amino-4,6-dichloro- (8CI)

Molecular Formula: C4H3Cl2N3Molecular Weight: 163.992720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JPZOAVGMSDSWSW-UHFFFAOYSA-N

• 3-Methylindole
IUPAC Name: 3-methyl-1H-indole | CAS Registry Number: 83-34-1
Synonyms: Skatole, Scatole, Skatol, 3-METHYLINDOLE, 3-Methyl-1H-indole, beta-Methylindole, Indole, 3-methyl-, 1H-Indole, 3-methyl-, 3 Methylindole, 3-methylindoline, methyl-3-indole, .beta.-Methylindole, 3-Methyl-4,5-benzopyrrole, 3-MI, FEMA No. 3019, CCRIS 8961, M51458_ALDRICH, HSDB 3511, MLS001332537, MLS001332538

Molecular Formula: C9H9NMolecular Weight: 131.174460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: ZFRKQXVRDFCRJG-UHFFFAOYSA-N

• 4-Bromoacetophenone
IUPAC Name: 1-(4-bromophenyl)ethanone | CAS Registry Number: 99-90-1
Synonyms: p-Bromoacetophenone, 4'-Bromoacetophenone, Acetophenone, 4'-bromo-, 1-(4-Bromophenyl)ethanone, Ethanone, 1-(4-bromophenyl)-, p-BROMACETOPHENONE, Methyl p-bromophenyl ketone, p-Bromophenyl methyl ketone, 1-Acetyl-4-bromobenzene, 4-BROMOACETOPHENONE, ACETOPHENONE,4-BROMO, B56404_ALDRICH, 16110_FLUKA, Acetophenone, 4'-bromo- (8CI), AIDS017953, AIDS-017953, NSC17541, EINECS 202-799-3, NSC 17541, ZINC00080820

Molecular Formula: C8H7BrOMolecular Weight: 199.044580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: WYECURVXVYPVAT-UHFFFAOYSA-N

• 2'-Chlorophenacyl bromide
IUPAC Name: 2-bromo-1-(2-chlorophenyl)ethanone | CAS Registry Number: 5000-66-8
Synonyms: 2-Bromo-2'-chloroacetophenone, 594482_ALDRICH, ZINC00166628, CID2735785, ST5214113

Molecular Formula: C8H6BrClOMolecular Weight: 233.489640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: WZWWEVCLPKAQTA-UHFFFAOYSA-N

• 2-Amino-5-bromonicotinic acid
IUPAC Name: 2-amino-5-bromopyridine-3-carboxylic acid | CAS Registry Number: 52833-94-0
Synonyms: 2-amino-5-bromonicotinic acid, SBB003380, ZINC00167541, AJ-333/25022118

Molecular Formula: C6H5BrN2O2Molecular Weight: 217.020100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: IEPDTLRHISNBLB-UHFFFAOYSA-N

• 4-Amino-6-chloropyrimidine
IUPAC Name: 6-chloropyrimidin-4-amine | CAS Registry Number: 5305-59-9
Synonyms: Streptomycin B, 4-Chloro-6-aminopyrimidine, 6-Chloro-pyrimidin-4-ylamine, NSC42134, ZINC01675006, BAS 05594136, ST5278163, TL8003485

Molecular Formula: C4H4ClN3Molecular Weight: 129.547660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DUKKRSPKJMHASP-UHFFFAOYSA-N

• 1-(3-Hydroxypropyl)-4-methylpiperazine
IUPAC Name: 3-(4-methylpiperazin-1-yl)propan-1-ol | CAS Registry Number: 5317-33-9
Synonyms: 4-Methyl-1-piperazinepropanol, 1-Piperazinepropanol, 4-methyl-, EINECS 226-177-6, NSC351986, 3-(4-Methyl-1-piperazine)propan-1-ol, 1-(3-Hydroxypropyl)-4-methyl-piperazine, SL-01902

Molecular Formula: C8H18N2OMolecular Weight: 158.241320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JKRSQNBRNIYETC-UHFFFAOYSA-N

• 3-(tert-Butyl)aniline
IUPAC Name: 3-tert-butylaniline | CAS Registry Number: 5369-19-7
Synonyms: 3-tert-Butylaniline, Aniline, m-tert-butyl-,, CID79334, EINECS 226-361-6, ZINC04242207, RF 01575, TL80074090

Molecular Formula: C10H15NMolecular Weight: 149.232800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: DPKTVUKEPNBABS-UHFFFAOYSA-N

• 3,4-Dinitrophenol
IUPAC Name: 3,4-dinitrophenol | CAS Registry Number: 577-71-9
Synonyms: 6,5-Dinitrophenol, 3,4-DINITROPHENOL, Phenol, 3,4-dinitro-, Ambap3677, 3,4-Dinitrofenol [Czech], 3,4-DNP, CCRIS 3105, 42195_FLUKA, CHEBI:39358, EINECS 209-415-3, BRN 1969398, LS-104568, 4-06-00-01384 (Beilstein Handbook Reference)

Molecular Formula: C6H4N2O5Molecular Weight: 184.106360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: AKLOLDQYWQAREW-UHFFFAOYSA-N

• 2,3-Diaminophenol
IUPAC Name: 2,3-diaminophenol | CAS Registry Number: 59649-56-8
Synonyms: Phenol, diamino-, zlchem 936, PubChem2129, AC1LBBSB, ACMC-209mex, 2,3-bis(azanyl)phenol, AC1Q7AKD, Phenol, 2,3-diamino-, SureCN190980, 340618_ALDRICH, CTK0J4316, ZLD0402, MolPort-003-930-565, ANW-33319, AR-1D2346, SBB069814, ZINC00389621, AKOS006223441, RP19581, AK-86237

Molecular Formula: C6H8N2OMolecular Weight: 124.140520 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: PCAXITAPTVOLGL-UHFFFAOYSA-N

• 6-Chloroquinoline
IUPAC Name: 6-chloroquinoline | CAS Registry Number: 612-57-7
Synonyms: Quinoline, 6-chloro-, CCRIS 3981, NSC4682, 375098_ALDRICH, NSC 4682, EINECS 210-314-1, CID69163, ZINC00066127, LS-188173, ST5405278, InChI=1/C9H6ClN/c10-8-3-4-9-7(6-8)2-1-5-11-9/h1-6

Molecular Formula: C9H6ClNMolecular Weight: 163.603640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GKJSZXGYFJBYRQ-UHFFFAOYSA-N

• 3,5-Dibromopyridine
IUPAC Name: 3,5-dibromopyridine | CAS Registry Number: 625-92-3
Synonyms: Pyridine, 3,5-dibromo-, NSC6209, 120162_ALDRICH, 34335_FLUKA, CHEBI:51593, ALBB-010182, CID69369, NSC 6209, EINECS 210-916-4, SBB003237, ZINC00032311, D2466G5, TL8004198, AC-907/30002039, InChI=1/C5H3Br2N/c6-4-1-5(7)3-8-2-4/h1-3

Molecular Formula: C5H3Br2NMolecular Weight: 236.892020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SOSPMXMEOFGPIM-UHFFFAOYSA-N

• 6-Aza-2-thiouracil
IUPAC Name: 3-sulfanylidene-2H-1,2,4-triazin-5-one | CAS Registry Number: 626-08-4
Synonyms: AIDS081848, AIDS-081848, EINECS 210-929-5, 3-thioxo-2H-1,2,4-triazin-5-one, CID1275976, as-Triazine-3,5(2H,4H)-dione, 3-thio-, 3,4-Dihydro-3-thioxo-1,2,4-triazin-5(2H)-one, 1,2,4-Triazin-5(2H)-one, 3,4-dihydro-3-thioxo-

Molecular Formula: C3H3N3OSMolecular Weight: 129.140420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HZPZCLDCTLLJTF-UHFFFAOYSA-N

• 3-Bromo-5-nitrobenzotrifluoride
IUPAC Name: 1-bromo-3-nitro-5-(trifluoromethyl)benzene | CAS Registry Number: 630125-49-4
Synonyms: 3-bromo-5-nitrobenzotrifluoride, 1-bromo-3-nitro-5-(trifluoromethyl)benzene, 5-bromo-3-(trifluoromethyl)nitrobenzene, 3-nitro-5-bromobenzotrifluoride, 3-bromo-5-trifluoromethylnitrobenzene, Benzene, 1-bromo-3-nitro-5-(trifluoromethyl)-, SBB063395, 1-Bromo-3-nitro-5-trifluoromethylbenzene, 3-bromo-1-nitro-5-(trifluoromethyl)benzene, ZINC02510823, zlchem 416, PubChem4047, ACMC-209nc5, SureCN788056, CTK5I6302, ZLC0270, MolPort-000-150-741, ACN-S004522, ACT13097, ANW-34515

Molecular Formula: C7H3BrF3NO2Molecular Weight: 270.003430 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: YHTVYRKVFAFVLP-UHFFFAOYSA-N

• 2-(Trifluoromethyl)benzophenone
IUPAC Name: phenyl-[2-(trifluoromethyl)phenyl]methanone | CAS Registry Number: 727-99-1
Synonyms: o-Trifluoromethylbenzophenone, 233129_ALDRICH, EINECS 211-972-2, ZINC00156502, Phenyl[2-(trifluoromethyl)phenyl]methanone, ST5307066

Molecular Formula: C14H9F3OMolecular Weight: 250.215870 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JXIWJBWMQXDALU-UHFFFAOYSA-N

• 2,3-Cresotaldehyde
IUPAC Name: 2-hydroxy-3-methylbenzaldehyde | CAS Registry Number: 824-42-0
Synonyms: 3-Methylsalicylaldehyde, 2-Hydroxy-3-methylbenzaldehyde, 444553_ALDRICH, CHEBI:20110, c0718, ST5308665, D1414, C14087, InChI=1/C8H8O2/c1-6-3-2-4-7(5-9)8(6)10/h2-5,10H,1H

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

InChIKey: IPPQNXSAJZOTJZ-UHFFFAOYSA-N

• 2-methyl-3-nitropyridine
IUPAC Name: 2-methyl-3-nitropyridine | CAS Registry Number: 18699-87-1
Synonyms: 2-Methyl-3-nitropyridine, NSC311455, CID329360, TL8001516, InChI=1/C6H6N2O2/c1-5-6(8(9)10)3-2-4-7-5/h2-4H,1H

Molecular Formula: C6H6N2O2Molecular Weight: 138.124040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: CCFGTKQIRWHYTB-UHFFFAOYSA-N

• 3-amino-3-(2-trifluoromethyl-phenyl)-propionic Acid
IUPAC Name: 3-amino-3-[2-(trifluoromethyl)phenyl]propanoic acid | CAS Registry Number: 299165-24-5
Synonyms: 3-amino-3-[2-(trifluoromethyl)phenyl]propanoic acid, 3-Amino-3-(2-(trifluoromethyl)phenyl)propanoic acid, ST50999741, 3-Amino-3-(2-trifluoromethyl-phenyl)-propionic acid, 3-Amino-3-(2-trifluoromethyl-phenyl)propionic acid, Enamine_000659, zlchem 572, ACMC-209oyz, AC1NOZ2Z, CTK4G4051, ZLD0010, HMS1395N21, ACT05929, AKOS000190728, AB08426, AG-E-97723, AK139912, KB-180547, FT-0659302, TL80073832

Molecular Formula: C10H10F3NO2Molecular Weight: 233.187110 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: MXKROQQTKYAUJB-UHFFFAOYSA-N

• 2'-Bromo-3,4-dichlorophenylacetic acid methyl ester
IUPAC Name: ethyl 2-bromo-2-(3,4-dichlorophenyl)acetate | CAS Registry Number: 41204-08-4
Synonyms: zlchem 1043, ZLD0509, ACT01132, KB-48460, Bromo-3,4-dichlorophenylacetic acid ethyl ester, |A-Bromo-3,4- dichlorophenylacetic acid ethyl ester, 2'-Bromo-3,4-dichlorophenylacetic acid ethyl ester, alpha-Bromo-3,4-Dichlorophenylacetic acid ethyl ester

Molecular Formula: C10H9BrCl2O2Molecular Weight: 311.987260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: YFJFMJXQSOSNLE-UHFFFAOYSA-N

• 3-Bromo-2-(bromomethyl)propionic acid
IUPAC Name: 3-bromo-2-(bromomethyl)propanoic acid | CAS Registry Number: 41459-42-1
Synonyms: .beta.,.beta.-Dibromoisobutyric acid, 301620_ALDRICH, 16493_FLUKA, beta,beta'-Dibromoisobutyric acid, CID318915, NSC259720, 3-Bromo-2-(bromomethyl)propanoic acid, Propanoic acid, 3-bromo-2-(bromomethyl)-, TL8002996

Molecular Formula: C4H6Br2O2Molecular Weight: 245.897240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QQZJWQCLWOQDQV-UHFFFAOYSA-N

• 2-(3-Benzoylphenyl)propionitrile
IUPAC Name: 2-[3-(benzoyl)phenyl]propanenitrile | CAS Registry Number: 42872-30-0
Synonyms: 2-(m-Benzoylphenyl)propionitrile, 196347_ALDRICH, EINECS 255-982-5, BRN 2844731, LS-29023, 24336 R.P, TL8007037, 24336 R.P., BENZENEACETONITRILE, 3-BENZOYL-alpha-METHYL-, Benzeneacetonitrile, 3-benzoyl-.alpha.-methyl-

Molecular Formula: C16H13NOMolecular Weight: 235.280520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RGYOCHMZSLUCNP-UHFFFAOYSA-N

• 1,3-Bis(bromomethyl)-5-methylbenzene
IUPAC Name: 1,3-bis(bromomethyl)-5-methylbenzene | CAS Registry Number: 19294-04-3
Synonyms: 3,5-Bis(bromomethyl)toluene, NSC243652, CID316162, ST5409004, TL8001581

Molecular Formula: C9H10Br2Molecular Weight: 277.983700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: AKDWRXXKHRUFMS-UHFFFAOYSA-N

• 5-Bromooxindole
IUPAC Name: 5-bromo-1,3-dihydroindol-2-one | CAS Registry Number: 20870-78-4
Synonyms: 5-Bromoindalin-2-on, 5-Bromo-2-oxindole, 586552_ALDRICH, CID611193, SBB005897, ZINC02565584, B2079G1, 5-Bromo-1,3-dihydro-2H-indol-2-one, TL8006280, B-8958

Molecular Formula: C8H6BrNOMolecular Weight: 212.043340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VIMNAEVMZXIKFL-UHFFFAOYSA-N

• 6-Bromohexanoyl chloride
IUPAC Name: 6-bromohexanoyl chloride | CAS Registry Number: 22809-37-6
Synonyms: 6-Bromocaproyl chloride, Hexanoyl chloride, 6-bromo-, 6-Bromohexanoic acid chloride, 235555_ALDRICH, ZINC02242612, CID89848, EINECS 245-236-7

Molecular Formula: C6H10BrClOMolecular Weight: 213.500000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HBPVGJGBRWIVSX-UHFFFAOYSA-N

• 3-Nitrobenzylamine hydrochloride
IUPAC Name: (3-nitrophenyl)methanamine | CAS Registry Number: 26177-43-5
Synonyms: Benzylamine der, 3-Nitrobenzylamine, meta-Nitrobenzylamine, (3-Nitrophenyl)methanamine, Benzenemethanamine, 3-nitro-, 3-Nitrobenzylammonium hydrochloride, AIDS011102, AIDS-011102, EINECS 247-502-8, SBB005862, BBV-084352, 26177-43-5 (HYDROCHLORIDE), 7409-18-9

Molecular Formula: C7H8N2O2Molecular Weight: 152.150620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CIUYJYRQKYGNQP-UHFFFAOYSA-N

• 6-Fluoro-2-tetralone
IUPAC Name: 6-fluoro-3,4-dihydro-1H-naphthalen-2-one | CAS Registry Number: 294919-14-5
Synonyms: 29419-14-5, 6-fluoro-3,4-dihydro-1H-naphthalen-2-one, 6-Fluoro-3,4-dihydronaphthalen-2(1H)-one, FLUOROTETRALONE, zlchem 689, AC1NNIAX, PubChem17949, SureCN588036, CTK4G3267, ZLD0141, MolPort-000-003-718, AM891, ACT05967, ANW-53139, WTI-10915, ZINC04202309, AKOS006343003, AB12639, AG-E-95779, AK-93398

Molecular Formula: C10H9FOMolecular Weight: 164.176263 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QMXOEISLPMFMBQ-UHFFFAOYSA-N

• 1-(4-Bromophenyl)-2-hydroxyethan-1-one
IUPAC Name: 1-(4-bromophenyl)-2-hydroxyethanone | CAS Registry Number: 3343-45-1
Synonyms: 1-(4-bromophenyl)-2-hydroxyethanone, 1-(4-bromophenyl)-2-hydroxyethan-1-one, CHEMBL1801618, SBB068790, 1-(4-Bromophenyl)-2-hydroxyethane-1-one, ZINC00167257, zlchem 616, AC1LAUIQ, bromophenylhydroxyethanone, SureCN55916, p-Bromo-a-hydroxy acetophenone, CTK4H0583, ZLD0066, MolPort-000-146-992, ACT05833, ANW-55081, AKOS005070623, 1-(4-bromophenyl)-2-hydroxy-ethanone, AG-F-12755, MCULE-5747207409

Molecular Formula: C8H7BrO2Molecular Weight: 215.043980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FGROGLJVXNYNQC-UHFFFAOYSA-N

• 3-(3-Fluoro-4-methoxybenzoyl)propionic acid
IUPAC Name: 4-(3-fluoro-4-methoxyphenyl)-4-oxobutanoic acid | CAS Registry Number: 347-63-7
Synonyms: 128368_ALDRICH, NSC87577, CID67671, EINECS 206-474-7, 3-(3-Fluoro-para-anisoyl)-propionic acid, ST5407954

Molecular Formula: C11H11FO4Molecular Weight: 226.201043 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: SNRFVYKMDZSFED-UHFFFAOYSA-N

• 1,5-dichloropentan-3-one
IUPAC Name: 1,5-dichloropentan-3-one | CAS Registry Number: 3592-25-4
Synonyms: 1,5-Dichloropentan-3-one, 1,5-dichlorpentan-3-on, 1,5-Dichloro-pentan-3-one, 36118-60-2, 1,5-Dichloro-3-pentanone, zlchem 115, PubChem2482, AC1LBNUC, AC1Q3UEC, 1,5-Dichloropentan-3-on, 3-Pentanone, 1,5-dichloro-, Jsp006434, CTK6H7230, ZLB0104, MolPort-003-986-788, KST-1B3572, 1 5-DICHLORO-3-PENTANONE, 1,5-Dichloropentan-3-one, tech., ACT02856, AC-873

Molecular Formula: C5H8Cl2OMolecular Weight: 155.022420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LYJQMHVYFFZQGY-UHFFFAOYSA-N

• 4-Fluorobenzenesulfonic acid
IUPAC Name: 4-fluorobenzenesulfonic acid | CAS Registry Number: 368-88-7
Synonyms: p-Fluorobenzenesulfonic acid, 4-Fluorobenzenesulphonic acid, Benzenesulfonic acid, 4-fluoro-, P-FLUOROBENZENSULFONIC ACID, CID46886, NSC43021, EINECS 206-714-0

Molecular Formula: C6H5FO3SMolecular Weight: 176.165503 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: WVSYONICNIDYBE-UHFFFAOYSA-N

• 4-Chloro-6,7-dimethoxyquinazoline
IUPAC Name: 4-chloro-6,7-dimethoxyquinazoline | CAS Registry Number: 13790-39-1
Synonyms: 4-Chloro-6,7-dimethoxy-quinazoline, AG-D-76903, Quinazoline, 4-chloro-6,7-dimethoxy-, F2113-0651, zlchem 87, ZINC02574919, PubChem9672, AC1MCGWT, ACMC-1BRD3, AC1Q470M, QUI040, Jsp002282, CTK4C1024, ZLB0075, MolPort-000-002-807, 4-Cholro-6,7-dimethoxyquinazoline, ACN-S003137, ACT01921, ANW-20362, SBB078276

Molecular Formula: C10H9ClN2O2Molecular Weight: 224.643660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: LLLHRNQLGUOJHP-UHFFFAOYSA-N

• 6,7-Dimethoxy-4(1H)-quinazolinone
IUPAC Name: 6,7-dimethoxy-1H-quinazolin-4-one | CAS Registry Number: 13794-72-4
Synonyms: Maybridge3_001466, Oprea1_495367, ZINC00116236, SDCCGMLS-0065808.P001, IDI1_012853, TL8000871, 6,7-Dimethoxy-3,4-dihydroquinazoline-4-one, 10N-834

Molecular Formula: C10H10N2O3Molecular Weight: 206.198000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: DMSRMHGCZUXCMJ-UHFFFAOYSA-N

• 4-Pregnen-20-beta-ol-3-one
IUPAC Name: (8S,9S,10R,13S,14S,17S)-17-[(1R)-1-hydroxyethyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one | CAS Registry Number: 145-15-3
Synonyms: 20-beta-Progerol, Progesterol-20-beta, 20-beta-Dihydroprogesterone, 20-beta-Hydroxyprogesterone, 20beta-Dihydroprogesterone, 4-Pregnen-2-beta-ol-3-one, 20-beta-Hydroxydihydroprogesterone, 20-beta-Hydroxypregn-4-en-3-one, 20beta-Hydroxy-pregn-4-en-3-one, (20R)-20-Hydroxypregn-4-en-3-one, CHEBI:36729, EINECS 205-650-0, 20beta-hydroxy-4-pregnen-3-one, 20beta-Hydroxypregn-4-en-3-one, Pregn-4-en-3-one, 20-beta-hydroxy-, LS-118758, Pregn-4-en-3-one, 20-hydroxy-, (20-R)-, Pregn-4-en-3-one, 20-hydroxy-, (20-R)- (9CI)

Molecular Formula: C21H32O2Molecular Weight: 316.477580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RWBRUCCWZPSBFC-SJOKZOANSA-N

• 5-Bromoindole-2-carboxylic acid ethyl ester
IUPAC Name: ethyl 5-bromo-1H-indole-2-carboxylate | CAS Registry Number: 16732-70-0
Synonyms: Oprea1_577377, NSC88620, CID259091, ZINC01509173, FA-0732, TL8001293, B-8720

Molecular Formula: C11H10BrNO2Molecular Weight: 268.106600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LWRLKENDQISGEU-UHFFFAOYSA-N


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