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Search results for: '5471-55-6'
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6-Bromo-2-chloro-3-methoxyphenylboronic acid(contains varying amounts of Anhydride)
Cas Number: 957062-55-4Formula: C7H7BBrClO3Molecular weight: 265.3Synonyms: 957062-55-4|6-Bromo-2-chloro-3-methoxyphenylboronic acid|(6-bromo-2-chloro-3-methoxyphenyl)boronic a...SMILES: B(C1=C(C=CC(=C1Cl)OC)Br)(O)OInChIKey: YITPGJUOVXQLPQ-UHFFFAOYSA-NInChI: InChI=1S/C7H7BBrClO3/c1-13-5-3-2-4(9)6(7(5)10)8(11)12/h2-3,11-12H,1H3
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4-Formyl-5-methoxy-N-phenylnicotinamide
Cas Number: 1142191-55-6Formula: C14H12N2O3Molecular weight: 256.26Synonyms: 1142191-55-6 | 4-Formyl-5-methoxy-N-phenylnicotinamide | 4-Formyl-5-methoxy-N-phenylnicotinamide, Al...SMILES: COC1=C(C(=CN=C1)C(=O)NC2=CC=CC=C2)C=OInChIKey: SXUZGAOQOYOTIT-UHFFFAOYSA-NInChI: InChI=1S/C14H12N2O3/c1-19-13-8-15-7-11(12(13)9-17)14(18)16-10-5-3-2-4-6-10/h2-9H,1H3,(H,16,18)
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methyl 3-bromo-1H-pyrazolo[4,3-b]pyridine-6-carboxylate
Cas Number: 1352398-55-0Formula: C8H6N3O2BrMolecular weight: 256.06Synonyms: methyl 3-bromo-1H-pyrazolo[4,3-b]pyridine-6-carboxylate | 1352398-55-0 | Methyl3-bromo-1h-pyrazolo[4...SMILES: COC(=O)C1=CC2=NNC(=C2N=C1)BrInChIKey: NAYWRQVHZWWJKK-UHFFFAOYSA-NInChI: InChI=1S/C8H6BrN3O2/c1-14-8(13)4-2-5-6(10-3-4)7(9)12-11-5/h2-3H,1H3,(H,11,12)
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3-Oxabicyclo[3.1.0]hexan-6-amine hydrochloride
Cas Number: 693248-55-4Formula: C5H10ClNOMolecular weight: 135.59Synonyms: 3-Oxabicyclo[3.1.0]hexan-6-amine hydrochloride|693248-55-4|3-oxabicyclo[3.1.0]hexan-6-amine;hydrochl...SMILES: C1C2C(C2N)CO1.ClInChIKey: JCFIYVURKHIYFF-UHFFFAOYSA-NInChI: InChI=1S/C5H9NO.ClH/c6-5-3-1-7-2-4(3)5;/h3-5H,1-2,6H2;1H
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6-Bromo-2H-1-Benzopyran-2-One
Cas Number: 19063-55-9Formula: C9H5BrO2Molecular weight: 225Synonyms: 6-bromochromen-2-one|19063-55-9|6-bromo-2H-chromen-2-one|6-bromocoumarin|2H-1-Benzopyran-2-one, 6-br...SMILES: C1=CC2=C(C=CC(=O)O2)C=C1BrInChIKey: XXRJDOQENVGLJT-UHFFFAOYSA-NInChI: InChI=1S/C9H5BrO2/c10-7-2-3-8-6(5-7)1-4-9(11)12-8/h1-5H
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N-(2-Chloroethyl)dibenzylamine Hydrochloride
Cas Number: 55-43-6Formula: C16H18ClN·HClMolecular weight: 296.24Synonyms: 55-43-6|N-(2-Chloroethyl)dibenzylamine hydrochloride|Dibenamine hydrochloride|N,N-dibenzyl-2-chloroe...SMILES: C1=CC=C(C=C1)CN(CCCl)CC2=CC=CC=C2.ClInChIKey: LZXCEBPGNFLHEQ-UHFFFAOYSA-NInChI: InChI=1S/C16H18ClN.ClH/c17-11-12-18(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;/h1-10H,11-14H2;1H
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1‐(benzenesulfonyl)‐6‐iodo‐2‐methyl‐1H‐indole
Cas Number: 1818847-55-0Formula: C15H12INO2SMolecular weight: 397.231Synonyms: 1818847-55-0|1-(Benzenesulfonyl)-6-iodo-2-methyl-1H-indole|6-Iodo-2-methyl-1-(phenylsulfonyl)-1H-ind...SMILES: CC1=CC2=C(N1S(=O)(=O)C3=CC=CC=C3)C=C(C=C2)IInChIKey: WAAJUAMRMKSCBU-UHFFFAOYSA-NInChI: InChI=1S/C15H12INO2S/c1-11-9-12-7-8-13(16)10-15(12)17(11)20(18,19)14-5-3-2-4-6-14/h2-10H,1H3
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methyl 6-nitro-1H-indazole-4-carboxylate
Synonyms: Methyl 6-nitro-1H-indazole-4-carboxylate|885518-55-8|6-Nitro-4-indazolecarboxylic acid methyl ester|...SMILES: COC(=O)C1=C2C=NNC2=CC(=C1)[N+](=O)[O-]InChIKey: HOJSKHUYDHPZKX-UHFFFAOYSA-NInChI: InChI=1S/C9H7N3O4/c1-16-9(13)6-2-5(12(14)15)3-8-7(6)4-10-11-8/h2-4H,1H3,(H,10,11)
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3-(3-Bromo-4-methoxyphenyl)pyridine
Cas Number: 914349-55-6Formula: C12H10BrNOMolecular weight: 264.1Synonyms: 3-(3-Bromo-4-methoxyphenyl)pyridine|914349-55-6|SCHEMBL4454661|DTXSID50661701|AMY33251|MFCD05864836|...SMILES: COC1=C(C=C(C=C1)C2=CN=CC=C2)BrInChIKey: KTVXJHMMCXLBSH-UHFFFAOYSA-NInChI: InChI=1S/C12H10BrNO/c1-15-12-5-4-9(7-11(12)13)10-3-2-6-14-8-10/h2-8H,1H3
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5-Bromo-4-chloro-6-methylpyrimidine
Cas Number: 3438-55-9Formula: C5H4BrClN2Molecular weight: 207.46Synonyms: 5-bromo-4-chloro-6-methylpyrimidine|3438-55-9|MFCD00234032|Pyrimidine, 5-bromo-4-chloro-6-methyl-|SC...SMILES: CC1=C(C(=NC=N1)Cl)BrInChIKey: COSNNPGRFRGVPC-UHFFFAOYSA-NInChI: InChI=1S/C5H4BrClN2/c1-3-4(6)5(7)9-2-8-3/h2H,1H3
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7-Bromo-1,2,3,4-tetrahydroisoquinoline
Cas Number: 17680-55-6Formula: C9H10BrNMolecular weight: 212.09Synonyms: 7-bromo-1,2,3,4-tetrahydroisoquinoline|17680-55-6|7-Bromo-1,2,3,4-tetrahydro-isoquinoline|Isoquinoli...SMILES: C1CNCC2=C1C=CC(=C2)BrInChIKey: OYODEQFZAJVROF-UHFFFAOYSA-NInChI: InChI=1S/C9H10BrN/c10-9-2-1-7-3-4-11-6-8(7)5-9/h1-2,5,11H,3-4,6H2
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tert-butyl 2-formyl-6-azaspiro[3.4]octane-6-carboxylate
Synonyms: tert-butyl 2-formyl-6-azaspiro[3.4]octane-6-carboxylate|203662-55-9|MFCD24857296|6-Azaspiro[3.4]octa...SMILES: CC(C)(C)OC(=O)N1CCC2(C1)CC(C2)C=OInChIKey: AQNPHZHLJTXPKM-UHFFFAOYSA-NInChI: InChI=1S/C13H21NO3/c1-12(2,3)17-11(16)14-5-4-13(9-14)6-10(7-13)8-15/h8,10H,4-7,9H2,1-3H3
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(-)-Scopolamine hydrochloride
Formula: C17H21NO4·HClMolecular weight: 339.81Synonyms: Hyoscine hydrochloride|Scopolamine hydrochloride|55-16-3|Scopolamine, hydrochloride|(-)-Scopolamine ...SMILES: CN1C2CC(CC1C3C2O3)OC(=O)C(CO)C4=CC=CC=C4.ClInChIKey: KXPXJGYSEPEXMF-WYHSTMEOSA-NInChI: InChI=1S/C17H21NO4.ClH/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10;/h2-6,11-16,19H,7-9H2,1H3;1H/t11?,12-,13-,14+,15-,16+;/m1./s1
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DL-Norepinephrine Hydrochloride
Formula: (HO)2C6H3CH(OH)CH2NH2 · HClMolecular weight: 205.64Synonyms: 55-27-6|dl-Norepinephrine hydrochloride|dl-Arterenol hydrochloride|dl-Noradrenaline hydrochloride|4-...SMILES: C1=CC(=C(C=C1C(CN)O)O)O.ClInChIKey: FQTFHMSZCSUVEU-UHFFFAOYSA-NInChI: InChI=1S/C8H11NO3.ClH/c9-4-8(12)5-1-2-6(10)7(11)3-5;/h1-3,8,10-12H,4,9H2;1H
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4-Bromo-6-chloro-2-(methylthio)benzo[d]thiazole
Cas Number: 1226808-55-4Formula: C8H5BrClNS2Molecular weight: 294.6Synonyms: 4-Bromo-6-chloro-2-(methylthio)benzo[d]thiazole|1226808-55-4|4-bromo-6-chloro-2-methylsulfanyl-1,3-b...SMILES: CSC1=NC2=C(S1)C=C(C=C2Br)ClInChIKey: MOSAQWDATOOVIX-UHFFFAOYSA-NInChI: InChI=1S/C8H5BrClNS2/c1-12-8-11-7-5(9)2-4(10)3-6(7)13-8/h2-3H,1H3
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Calcium pyrophosphate
Formula: Ca2P2O7Molecular weight: 254.10Synonyms: HSDB 1435 | CALCIUMPYROPHOSPHATE | CALCIUM PYROPHOSPHATE [MI] | MFCD00015983 | Calcium pyrophosphate...SMILES: [O-]P(=O)([O-])OP(=O)([O-])[O-].[Ca+2].[Ca+2]InChIKey: JUNWLZAGQLJVLR-UHFFFAOYSA-JInChI: InChI=1S/2Ca.H4O7P2/c;;1-8(2,3)7-9(4,5)6/h;;(H2,1,2,3)(H2,4,5,6)/q2*+2;/p-4
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6-Chloropyrimidin-2(1H)-one
Cas Number: 80927-55-5Formula: C4H3ClN2OMolecular weight: 130.53Synonyms: 6-Chloropyrimidin-2(1H)-one|80927-55-5|6-chloro-1H-pyrimidin-2-one|chloropyrimidone|4-Chloro-pyrimid...SMILES: C1=C(NC(=O)N=C1)ClInChIKey: KVHNGYWHLLJFNQ-UHFFFAOYSA-NInChI: InChI=1S/C4H3ClN2O/c5-3-1-2-6-4(8)7-3/h1-2H,(H,6,7,8)
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3,4-dimethyl-1H-pyrrole-2-carboxylic acid
Cas Number: 89776-55-6Formula: C7H9NO2Molecular weight: 139.154Synonyms: 3,4-Dimethyl-1H-pyrrole-2-carboxylic acid|89776-55-6|MFCD00030400|3,4-Dimethyl-1H-pyrrole-2-carboxyl...SMILES: CC1=CNC(=C1C)C(=O)OInChIKey: IEOJTKFLLYADNV-UHFFFAOYSA-NInChI: InChI=1S/C7H9NO2/c1-4-3-8-6(5(4)2)7(9)10/h3,8H,1-2H3,(H,9,10)
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Gefitinib hydrochloride salt
Cas Number: 184475-55-6Formula: C22H25Cl2FN4O3Molecular weight: 483.37Synonyms: Gefitinib hydrochloride|184475-55-6|gefitinib hcl|Gefitinib (hydrochloride)|ZD-1839 hydrochloride|Ge...SMILES: COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OCCCN4CCOCC4.ClInChIKey: QUINXWLATMJDQF-UHFFFAOYSA-NInChI: InChI=1S/C22H24ClFN4O3.ClH/c1-29-20-13-19-16(12-21(20)31-8-2-5-28-6-9-30-10-7-28)22(26-14-25-19)27-15-3-4-18(24)17(23)11-15;/h3-4,11-14H,2,5-10H2,1H3,(H,25,26,27);1H
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Benzyl octyl adipate
Cas Number: 3089-55-2Formula: C21H32O4Molecular weight: 348.48Synonyms: Benzyl octyl adipate|3089-55-2|Hexanedioic acid, octyl phenylmethyl ester|6-O-benzyl 1-O-octyl hexan...SMILES: CCCCCCCCOC(=O)CCCCC(=O)OCC1=CC=CC=C1InChIKey: DECACTMEFWAFRE-UHFFFAOYSA-NInChI: InChI=1S/C21H32O4/c1-2-3-4-5-6-12-17-24-20(22)15-10-11-16-21(23)25-18-19-13-8-7-9-14-19/h7-9,13-14H,2-6,10-12,15-18H2,1H3
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Tinoridine Hydrochloride
Cas Number: 25913-34-2Formula: C17H20N2O2S•HClMolecular weight: 352.88Synonyms: tinoridine hydrochloride|25913-34-2|Tinoridine HCl|Nonflamin|Y-3642 hydrochloride|Dimaten|24237-55-6...SMILES: CCOC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)N.ClInChIKey: LMAQHEGFQZGATE-UHFFFAOYSA-NInChI: InChI=1S/C17H20N2O2S.ClH/c1-2-21-17(20)15-13-8-9-19(11-14(13)22-16(15)18)10-12-6-4-3-5-7-12;/h3-7H,2,8-11,18H2,1H3;1H
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1,2-Propanediol
Formula: C3H8O2Molecular weight: 76.09Synonyms: propylene glycol|1,2-propanediol|propane-1,2-diol|57-55-6|1,2-Propylene glycol|1,2-dihydroxypropane|...SMILES: CC(CO)OInChIKey: DNIAPMSPPWPWGF-UHFFFAOYSA-NInChI: InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3
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6-chloro-3-iodo-1H-pyrrolo[3,2-c]pyridine
Cas Number: 1000341-55-8Formula: C7H4ClIN2Molecular weight: 278.48Synonyms: I10889 | 6-Chloro-3-iodo-1H-pyrrolo[3,2-c]pyridine | AMY9862 | SCHEMBL15742054 | A1-26838 | PB48083 ...SMILES: C1=C2C(=CN=C1Cl)C(=CN2)IInChIKey: OFYFYASYSPIQPM-UHFFFAOYSA-NInChI: InChI=1S/C7H4ClIN2/c8-7-1-6-4(2-11-7)5(9)3-10-6/h1-3,10H
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2 Citations 
