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Search results for: '813-814-3'
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4,5,6,7-tetrahydrotriazolo[1,5-a]pyrazine
Cas Number: 123291-54-3 EC Number: 814-177-4Formula: C5H8N4Molecular weight: 124.14SMILES: C1CN2C(=CN=N2)CN1InChIKey: RMXGROKBRJVWRN-UHFFFAOYSA-NInChI: InChI=1S/C5H8N4/c1-2-9-5(3-6-1)4-7-8-9/h4,6H,1-3H2
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2,2′-(4-Methylphenylimino)diethanol
Cas Number: 3077-12-1Formula: C11H17NO2Molecular weight: 195.26Synonyms: dihydroxyethyl toluidine | DTXSID0044650 | CCRIS 814 | N-(4-Methylphenyl)-N,N-diethanolamine | N,N-B...SMILES: CC1=CC=C(C=C1)N(CCO)CCOInChIKey: JUVSRZCUMWZBFK-UHFFFAOYSA-NInChI: InChI=1S/C11H17NO2/c1-10-2-4-11(5-3-10)12(6-8-13)7-9-14/h2-5,13-14H,6-9H2,1H3
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2-Bromo-5-iodophenol
Cas Number: 932372-99-1 EC Number: 873-410-8Formula: C6H4BrIOMolecular weight: 298.9Synonyms: MB08154 | AKOS015856267 | SCHEMBL1106939 | FT-0602297 | 2-BROMO-5-IODOPHENOL | DTXSID40676369 | AMY2...SMILES: C1=CC(=C(C=C1I)O)BrInChIKey: VRITXTVQJJMQIT-UHFFFAOYSA-NInChI: InChI=1S/C6H4BrIO/c7-5-2-1-4(8)3-6(5)9/h1-3,9H
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Vardenafil
Cas Number: 28898-03-5Formula: C12H11FN2Molecular weight: 202.23Synonyms: AS-813/43501974 | MFCD10567164 | N-(2-Fluorophenyl)-1,2-diaminobenzene | N~1~-(2-fluorophenyl)-1,2-b...SMILES: C1=CC=C(C(=C1)N)NC2=CC=CC=C2FInChIKey: OYGRPIXAYJLZEN-UHFFFAOYSA-NInChI: InChI=1S/C12H11FN2/c13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14/h1-8,15H,14H2
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2,6-Dibromopurine
SMILES: C1=NC2=C(N1)C(=NC(=N2)Br)BrInChIKey: YPFDNCJJFMAZPJ-UHFFFAOYSA-NInChI: InChI=1S/C5H2Br2N4/c6-3-2-4(9-1-8-2)11-5(7)10-3/h1H,(H,8,9,10,11)
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5-iodo-2-(trifluoromethyl)pyridin-4-ol
Cas Number: 1027818-89-8 EC Number: 869-198-1Formula: C6H3NOF3IMolecular weight: 288.99Synonyms: PB39409 | AS-813/43501868 | Z1681357903 | 5-iodo-2-(trifluoromethyl)-1H-pyridin-4-one | 1027818-89-8...SMILES: C1=C(NC=C(C1=O)I)C(F)(F)FInChIKey: CGLFJGAJEPFGDZ-UHFFFAOYSA-NInChI: InChI=1S/C6H3F3INO/c7-6(8,9)5-1-4(12)3(10)2-11-5/h1-2H,(H,11,12)
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2,6-Difluoro-4-(trifluoromethyl)benzoic acid
Cas Number: 1309597-24-7Formula: C8H3F5O2Molecular weight: 226.10Synonyms: AS-813/43501795 | AT19243 | Z1793805431 | AKOS024263333 | 2,6-difluoro-4-(trifluoromethyl)benzoic ac...SMILES: C1=C(C=C(C(=C1F)C(=O)O)F)C(F)(F)FInChIKey: RYWDDEGVJSAZLQ-UHFFFAOYSA-NInChI: InChI=1S/C8H3F5O2/c9-4-1-3(8(11,12)13)2-5(10)6(4)7(14)15/h1-2H,(H,14,15)
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Isopropyl 2-pyridyl ketone
Cas Number: 59576-30-6Formula: C9H11NOMolecular weight: 149.2Synonyms: Isopropyl 2-pyridyl ketone|59576-30-6|2-methyl-1-(pyridin-2-yl)propan-1-one|2-methyl-1-pyridin-2-ylp...SMILES: CC(C)C(=O)C1=CC=CC=N1InChIKey: OPPJOYDMQXHCFS-UHFFFAOYSA-NInChI: InChI=1S/C9H11NO/c1-7(2)9(11)8-5-3-4-6-10-8/h3-7H,1-2H3
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Diethylene glycol butyl ether methacrylate
Cas Number: 7328-22-5Formula: C12H22O4Molecular weight: 230.3Synonyms: EINECS 230-813-8 | SCHEMBL36708 | 2-(2-Butoxyethoxy)ethyl methacrylate | 2-Propenoic acid,2-methyl-,...SMILES: CCCCOCCOCCOC(=O)C(=C)CInChIKey: QGTBRAFPWNISIJ-UHFFFAOYSA-NInChI: InChI=1S/C12H22O4/c1-4-5-6-14-7-8-15-9-10-16-12(13)11(2)3/h2,4-10H2,1,3H3
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Calcium thioglycolate
Cas Number: 814-71-1Formula: C4H6CaO4S2Molecular weight: 222.3SMILES: C(C(=O)[O-])S.C(C(=O)[O-])S.[Ca+2]InChIKey: CNYFJCCVJNARLE-UHFFFAOYSA-LInChI: InChI=1S/2C2H4O2S.Ca/c2*3-2(4)1-5;/h2*5H,1H2,(H,3,4);/q;;+2/p-2
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2-Bromo-4-iodo-1-methoxybenzene
Cas Number: 182056-39-9Formula: C7H6BrIOMolecular weight: 312.93Synonyms: 2-Bromo-4-iodoanisole | Benzene, 2-bromo-4-iodo-1-methoxy- | AKOS009255805 | AMY28426 | SCHEMBL24988...SMILES: COC1=C(C=C(C=C1)I)BrInChIKey: YIQMMXVWWSWNGR-UHFFFAOYSA-NInChI: InChI=1S/C7H6BrIO/c1-10-7-3-2-5(9)4-6(7)8/h2-4H,1H3
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3-(Methoxymethylene)-2(3H)-benzofuranone
Cas Number: 40800-90-6 EC Number: 813-144-1SMILES: COC=C1C2=CC=CC=C2OC1=OInChIKey: YDHPXCHZYXPZIS-VURMDHGXSA-NInChI: InChI=1S/C10H8O3/c1-12-6-8-7-4-2-3-5-9(7)13-10(8)11/h2-6H,1H3/b8-6-
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3-Bromo-5-(hydroxymethyl)benzonitrile
Cas Number: 1205515-06-5 EC Number: 813-284-3Formula: C8H6BrNOMolecular weight: 212.04SMILES: C1=C(C=C(C=C1C#N)Br)COInChIKey: NDZGRXPTEKVBMA-UHFFFAOYSA-NInChI: InChI=1S/C8H6BrNO/c9-8-2-6(4-10)1-7(3-8)5-11/h1-3,11H,5H2
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Ethyl 2-((6-amino-2,3-dichlorobenzyl)amino)acetate
Cas Number: 70406-92-7 EC Number: 813-025-4Formula: C11H14Cl2N2O2Molecular weight: 277.14SMILES: CCOC(=O)CNCC1=C(C=CC(=C1Cl)Cl)NInChIKey: GXKCDDOGWWCMAO-UHFFFAOYSA-NInChI: InChI=1S/C11H14Cl2N2O2/c1-2-17-10(16)6-15-5-7-9(14)4-3-8(12)11(7)13/h3-4,15H,2,5-6,14H2,1H3
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3,6-Dinitro-9H-carbazole
SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C3=C(N2)C=CC(=C3)[N+](=O)[O-]InChIKey: IARXLBTXILYASE-UHFFFAOYSA-NInChI: InChI=1S/C12H7N3O4/c16-14(17)7-1-3-11-9(5-7)10-6-8(15(18)19)2-4-12(10)13-11/h1-6,13H
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Ginsenoside Re
Cas Number: 52286-59-6Formula: C48H82O18Molecular weight: 947.14Synonyms: Ginsenoside Re|52286-59-6|Ginsenoside B2|Panaxoside RE|Chikusetsusaponin IVc|ginsenoside-Re|Sanchino...SMILES: CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CC4(C(CC(C5C4(CCC5C(C)(CCC=C(C)C)OC6C(C(C(C(O6)CO)O)O)O)C)O)C7(C3C(C(CC7)O)(C)C)C)C)CO)O)O)O)O)OInChIKey: PWAOOJDMFUQOKB-WCZZMFLVSA-NInChI: See more
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3,5-DINITRO-4-HYDROXYBENZOIC ACID
SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])C(=O)OInChIKey: GBSWIDSKAJFWMF-UHFFFAOYSA-NInChI: InChI=1S/C7H4N2O7/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2,10H,(H,11,12)
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4-Bromo-6-methylisoquinoline
Cas Number: 1204298-52-1Formula: C10H8BrNMolecular weight: 222.1Synonyms: 4-Bromo-6-methylisoquinoline|1204298-52-1|SCHEMBL17981072|DTXSID70676670|MFCD12922845|AKOS015842592|...SMILES: CC1=CC2=C(C=NC=C2C=C1)BrInChIKey: UQKURXKBUHYNAT-UHFFFAOYSA-NInChI: InChI=1S/C10H8BrN/c1-7-2-3-8-5-12-6-10(11)9(8)4-7/h2-6H,1H3
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Dioctyl(maleate)tin
Cas Number: 16091-18-2Formula: C20H36O4SnMolecular weight: 459.21Synonyms: 2,2-dioctyl-1,3,2-dioxastannepine-4,7-dione | 2,3,2-dioxastannepin-4,7-dione | R8D5H6C67T | MFCD0004...SMILES: CCCCCCCC[Sn]1(OC(=O)C=CC(=O)O1)CCCCCCCCInChIKey: PZGVVCOOWYSSGB-UHFFFAOYSA-LInChI: InChI=1S/2C8H17.C4H4O4.Sn/c2*1-3-5-7-8-6-4-2;5-3(6)1-2-4(7)8;/h2*1,3-8H2,2H3;1-2H,(H,5,6)(H,7,8);/q;;;+2/p-2
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2,4-Dichloro-6-iodoaniline
Cas Number: 697-90-5Formula: C6H4Cl2INMolecular weight: 287.92Synonyms: 2,4-dichloro-6-iodoaniline|697-90-5|SCHEMBL2766389|DTXSID40428820|2,4-Dichloro-6-iodo-phenylamine|YJ...SMILES: C1=C(C=C(C(=C1Cl)N)I)ClInChIKey: YJRSMJTVXWBFJJ-UHFFFAOYSA-NInChI: InChI=1S/C6H4Cl2IN/c7-3-1-4(8)6(10)5(9)2-3/h1-2H,10H2
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Altertoxin I (Dihydroalterperylenol)
Cas Number: 56258-32-3 EC Number: 814-312-7SMILES: C1CC2(C3C(CC(=O)C4=C(C=CC(=C34)C5=C2C(=C(C=C5)O)C1=O)O)O)OInChIKey: GJIALGLHOBXNAT-KPOBHBOGSA-NInChI: InChI=1S/C20H16O6/c21-10-3-1-8-9-2-4-11(22)17-12(23)5-6-20(26,18(9)17)19-14(25)7-13(24)16(10)15(8)19/h1-4,14,19,21-22,25-26H,5-7H2/t14-,19+,20-/m0/s1
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cis-4-(hydroxymethyl)cyclohexanol
Formula: C7H14O2Molecular weight: 130.18Synonyms: cis-4-HydroxycyclohexanemethanolSMILES: C1CC(CCC1CO)OInChIKey: VGRZISGVNOKTQU-UHFFFAOYSA-NInChI: InChI=1S/C7H14O2/c8-5-6-1-3-7(9)4-2-6/h6-9H,1-5H2
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3-(4-Fluorophenyl)-2-methylpropanoic acid
Cas Number: 22138-73-4 EC Number: 814-962-1SMILES: CC(CC1=CC=C(C=C1)F)C(=O)OInChIKey: KPWBMCKJLTZFFT-UHFFFAOYSA-NInChI: InChI=1S/C10H11FO2/c1-7(10(12)13)6-8-2-4-9(11)5-3-8/h2-5,7H,6H2,1H3,(H,12,13)
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