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Search results for: '5493-45-8'
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Pyrido[2,3-b]pyrazin-6(5H)-one
Cas Number: 35808-45-8Formula: C7H5N3OMolecular weight: 147.13Synonyms: Pyrido[2,3-b]pyrazin-6(5H)-one|35808-45-8|5H-pyrido[2,3-b]pyrazin-6-one|5H,6H-pyrido[2,3-b]pyrazin-6...SMILES: C1=CC(=O)NC2=NC=CN=C21InChIKey: KGCASACLSNTYGM-UHFFFAOYSA-NInChI: InChI=1S/C7H5N3O/c11-6-2-1-5-7(10-6)9-4-3-8-5/h1-4H,(H,9,10,11)
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2-((4-Chlorophenyl)(piperidin-4-yloxy)methyl)pyridine 4-nitrobenzoate
Cas Number: 161558-45-8Formula: C24H24ClN3O5Molecular weight: 469.93Synonyms: 161558-45-8|2-((4-Chlorophenyl)(piperidin-4-yloxy)methyl)pyridine 4-nitrobenzoate|4-[(4-Chlorophenyl...SMILES: C1CNCCC1OC(C2=CC=C(C=C2)Cl)C3=CC=CC=N3.C1=CC(=CC=C1C(=O)O)[N+](=O)[O-]InChIKey: UQSUJCNJGVBZCU-UHFFFAOYSA-NInChI: InChI=1S/C17H19ClN2O.C7H5NO4/c18-14-6-4-13(5-7-14)17(16-3-1-2-10-20-16)21-15-8-11-19-12-9-15;9-7(10)5-1-3-6(4-2-5)8(11)12/h1-7,10,15,17,19H,8-9,11-12H2;1-4H,(H,9,10)
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10-Undecenal
Formula: C11H20OMolecular weight: 168.28Synonyms: CAS-112-45-8 | FEMA No. 3095 | EINECS 203-973-1 | NCGC00255582-01 | n-UNDECYLENIC ALDEHYDE (10-1) | ...SMILES: C=CCCCCCCCCC=OInChIKey: OFHHDSQXFXLTKC-UHFFFAOYSA-NInChI: InChI=1S/C11H20O/c1-2-3-4-5-6-7-8-9-10-11-12/h2,11H,1,3-10H2
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Methyl acetoacetate
Formula: C5H8O3Molecular weight: 116.12Synonyms: CAS-105-45-3 | s3091 | Tox21_200162 | 3-Oxobutyric Acid Methyl Ester | 3-oxo-butyric acid methyl est...SMILES: CC(=O)CC(=O)OCInChIKey: WRQNANDWMGAFTP-UHFFFAOYSA-NInChI: InChI=1S/C5H8O3/c1-4(6)3-5(7)8-2/h3H2,1-2H3
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5-chloro-1H-pyrazolo[4,3-b]pyridine
Cas Number: 94220-45-8Formula: C6H4ClN3Molecular weight: 153.57Synonyms: 5-Chloro-1H-pyrazolo[4,3-b]pyridine|94220-45-8|MFCD05663984|1H-Pyrazolo[4,3-b]pyridine, 5-chloro-|SC...SMILES: C1=CC(=NC2=C1NN=C2)ClInChIKey: PYZUYYOYVZFJGX-UHFFFAOYSA-NInChI: InChI=1S/C6H4ClN3/c7-6-2-1-4-5(9-6)3-8-10-4/h1-3H,(H,8,10)
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7-Nitroindole-2-carboxylic acid
Formula: C9H6N2O4Molecular weight: 206.16Synonyms: 7-Nitroindole-2-carboxylic acid|6960-45-8|7-Nitro-1H-indole-2-carboxylic acid|CRT0044876|1H-Indole-2...SMILES: C1=CC2=C(C(=C1)[N+](=O)[O-])NC(=C2)C(=O)OInChIKey: BIUCOFQROHIAEO-UHFFFAOYSA-NInChI: InChI=1S/C9H6N2O4/c12-9(13)6-4-5-2-1-3-7(11(14)15)8(5)10-6/h1-4,10H,(H,12,13)
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tert-butyl (1R,3S,5R)-3-(hydroxymethyl)-5-methyl-2-azabicyclo[3.1.0]hexane-2-carboxylate
Cas Number: 1522367-45-8Formula: C12H21NO3Molecular weight: 227.3Synonyms: 1522367-45-8 | tert-butyl (1R,3S,5R)-3-(hydroxymethyl)-5-methyl-2-azabicyclo[3.1.0]hexane-2-carboxyl...SMILES: CC12CC(N(C1C2)C(=O)OC(C)(C)C)COInChIKey: IGPQGEGCVGXHSS-SBMIAAHKSA-NInChI: InChI=1S/C12H21NO3/c1-11(2,3)16-10(15)13-8(7-14)5-12(4)6-9(12)13/h8-9,14H,5-7H2,1-4H3/t8-,9+,12-/m0/s1
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1-Butyl-3-vinyliMidazoliuM broMide
Cas Number: 1033461-45-8Formula: C9H15BrN2Molecular weight: 231.13Synonyms: AS-61646 | SCHEMBL3700399 | 3-Butyl-1-vinyl-1H-imidazol-3-ium bromide | 3-Butyl-1-vinyl-1H-imidazol-...SMILES: CCCC[N+]1=CN(C=C1)C=C.[Br-]InChIKey: XALVOFYVVOAYPO-UHFFFAOYSA-MInChI: InChI=1S/C9H15N2.BrH/c1-3-5-6-11-8-7-10(4-2)9-11;/h4,7-9H,2-3,5-6H2,1H3;1H/q+1;/p-1
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Ethyl 4-((2-amino-4-chlorophenyl)amino)piperidine-1-carboxylate
Cas Number: 53786-45-1Formula: C14H20ClN3O2Molecular weight: 297.78Synonyms: 53786-45-1|Ethyl 4-((2-amino-4-chlorophenyl)amino)piperidine-1-carboxylate|ethyl 4-(2-amino-4-chloro...SMILES: CCOC(=O)N1CCC(CC1)NC2=C(C=C(C=C2)Cl)NInChIKey: PPCPQDDCMQRJLS-UHFFFAOYSA-NInChI: InChI=1S/C14H20ClN3O2/c1-2-20-14(19)18-7-5-11(6-8-18)17-13-4-3-10(15)9-12(13)16/h3-4,9,11,17H,2,5-8,16H2,1H3
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1-(3-methyloxetan-3-yl)ethanamine;hemi(oxalic acid)
Cas Number: 2102409-45-8Synonyms: bis(1-(3-methyloxetan-3-yl)ethan-1-amine) | oxalic acid | 2102409-45-8 | 1-(3-methyloxetan-3-yl)etha...SMILES: CC(C1(COC1)C)N.CC(C1(COC1)C)N.C(=O)(C(=O)O)OInChIKey: PDSWECOZQQUACZ-UHFFFAOYSA-NInChI: InChI=1S/2C6H13NO.C2H2O4/c2*1-5(7)6(2)3-8-4-6;3-1(4)2(5)6/h2*5H,3-4,7H2,1-2H3;(H,3,4)(H,5,6)
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tert-butyl 1,6-diazaspiro[3.5]nonane-6-carboxylate hemioxalate
Synonyms: 1630906-45-4|tert-butyl 1,6-diazaspiro[3.5]nonane-6-carboxylate hemioxalate|tert-Butyl 1,6-diazaspir...SMILES: CC(C)(C)OC(=O)N1CCCC2(C1)CCN2.CC(C)(C)OC(=O)N1CCCC2(C1)CCN2.C(=O)(C(=O)O)OInChIKey: WTODIOPHLRZZTM-UHFFFAOYSA-NInChI: InChI=1S/2C12H22N2O2.C2H2O4/c2*1-11(2,3)16-10(15)14-8-4-5-12(9-14)6-7-13-12;3-1(4)2(5)6/h2*13H,4-9H2,1-3H3;(H,3,4)(H,5,6)
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Carbon nanotube, multi-walled
Cas Number: 308068-56-6Formula: CMolecular weight: 12.01Synonyms: 05113_FLUKA | 05105_FLUKA | 05110_FLUKA | 05123_FLUKA | 05120_FLUKA | 05112_FLUKA | Multiwall carbon...SMILES: [C]InChIKey: OKTJSMMVPCPJKN-UHFFFAOYSA-NInChI: InChI=1S/C
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trans-cyclopropane-1,2-dicarboxylic acid
Synonyms: 696-75-3|(1R,2R)-cyclopropane-1,2-dicarboxylic acid|trans-cyclopropane-1,2-dicarboxylic acid|58616-9...SMILES: C1C(C1C(=O)O)C(=O)OInChIKey: RLWFMZKPPHHHCB-PWNYCUMCSA-NInChI: InChI=1S/C5H6O4/c6-4(7)2-1-3(2)5(8)9/h2-3H,1H2,(H,6,7)(H,8,9)/t2-,3-/m1/s1
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5-(4-Chlorophenyl)-2-furoic acid
Cas Number: 41019-45-8Formula: C11H7ClO3Molecular weight: 222.62Synonyms: 5-(4-Chlorophenyl)-2-furoic acid|41019-45-8|5-(4-chlorophenyl)furan-2-carboxylic Acid|CHEMBL197430|5...SMILES: C1=CC(=CC=C1C2=CC=C(O2)C(=O)O)ClInChIKey: XIPQHWUSDHTXOO-UHFFFAOYSA-NInChI: InChI=1S/C11H7ClO3/c12-8-3-1-7(2-4-8)9-5-6-10(15-9)11(13)14/h1-6H,(H,13,14)
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2-Bromo-5-hydroxypyridine
Cas Number: 55717-45-8Formula: C5H4BrNOMolecular weight: 174Synonyms: 2-Bromo-5-hydroxypyridine|6-Bromopyridin-3-ol|55717-45-8|55717-40-3|6-Bromo-3-pyridinol|6-bromo-3-hy...SMILES: C1=CC(=NC=C1O)BrInChIKey: PTEFNEALEPSHLC-UHFFFAOYSA-NInChI: InChI=1S/C5H4BrNO/c6-5-2-1-4(8)3-7-5/h1-3,8H
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4-Methoxy-2-methylpyrimidin-5-amine
Cas Number: 53135-45-8Formula: C6H9N3OMolecular weight: 139.16Synonyms: 4-methoxy-2-methylpyrimidin-5-amine|53135-45-8|4-Methoxy-2-methyl-5-pyrimidinamine|DTXSID90590889|MF...SMILES: CC1=NC=C(C(=N1)OC)NInChIKey: XEGDLNODDATISE-UHFFFAOYSA-NInChI: InChI=1S/C6H9N3O/c1-4-8-3-5(7)6(9-4)10-2/h3H,7H2,1-2H3
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Cinnamyl acetate
Formula: C11H12O2Molecular weight: 176.21Synonyms: Cinnamyl acetate|103-54-8|3-Phenylallyl acetate|(E)-Cinnamyl acetate|21040-45-9|3-Phenyl-2-propenyl ...SMILES: CC(=O)OCC=CC1=CC=CC=C1InChIKey: WJSDHUCWMSHDCR-VMPITWQZSA-NInChI: InChI=1S/C11H12O2/c1-10(12)13-9-5-8-11-6-3-2-4-7-11/h2-8H,9H2,1H3/b8-5+
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1-BOC 6-bromo-3,4-dihydro-2H-quinoline
Cas Number: 1123169-45-8Formula: C14H18BrNO2Molecular weight: 312.2Synonyms: 1123169-45-8|tert-Butyl 6-bromo-3,4-dihydroquinoline-1(2H)-carboxylate|1-BOC 6-bromo-3,4-dihydro-2H-...SMILES: CC(C)(C)OC(=O)N1CCCC2=C1C=CC(=C2)BrInChIKey: HXVKARGTRMNFQU-UHFFFAOYSA-NInChI: InChI=1S/C14H18BrNO2/c1-14(2,3)18-13(17)16-8-4-5-10-9-11(15)6-7-12(10)16/h6-7,9H,4-5,8H2,1-3H3
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1-tert-butyl 2-methyl (2S,4S)-4-[(tert-butyldimethylsilyl)oxy]pyrrolidine-1,2-dicarboxylate
Cas Number: 367966-45-8Formula: C17H33NO5SiMolecular weight: 359.53Synonyms: 367966-45-8 | (2S,4S)-1-tert-Butyl 2-methyl 4-((tert-butyldimethylsilyl)oxy)pyrrolidine-1,2-dicarbox...SMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)OC)O[Si](C)(C)C(C)(C)CInChIKey: GDGVOGGJKRMIOF-STQMWFEESA-NInChI: InChI=1S/C17H33NO5Si/c1-16(2,3)22-15(20)18-11-12(10-13(18)14(19)21-7)23-24(8,9)17(4,5)6/h12-13H,10-11H2,1-9H3/t12-,13-/m0/s1
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PHTHALIDENEACETIC ACID
Cas Number: 4743-57-1Formula: C10H6O4Molecular weight: 190.157Synonyms: 4743-57-1|(2Z)-(3-oxo-2-benzofuran-1(3H)-ylidene)acetic acid|125213-45-8|2-(3-oxo-1,3-dihydroisobenz...SMILES: C1=CC=C2C(=C1)C(=CC(=O)O)OC2=OInChIKey: XKMGDVJBAWUUDZ-YVMONPNESA-NInChI: InChI=1S/C10H6O4/c11-9(12)5-8-6-3-1-2-4-7(6)10(13)14-8/h1-5H,(H,11,12)/b8-5-
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Methyl 3-methyl-1H-pyrazole-4-carboxylate
Cas Number: 23170-45-8Formula: C6H8N2O2Molecular weight: 140.14Synonyms: Methyl 3-methyl-1H-pyrazole-4-carboxylate|23170-45-8|methyl 5-methyl-1H-pyrazole-4-carboxylate|1H-Py...SMILES: CC1=C(C=NN1)C(=O)OCInChIKey: CRMIQSQQCPLMIJ-UHFFFAOYSA-NInChI: InChI=1S/C6H8N2O2/c1-4-5(3-7-8-4)6(9)10-2/h3H,1-2H3,(H,7,8)
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(±)-Gossypol from cotton seeds
Cas Number: 303-45-7Formula: C30H30O8Molecular weight: 518.55Synonyms: gossypol|303-45-7|90141-22-3|(-)-Gossypol|Pogosin|(+)-Gossypol|Tash 1|(R)-Gossypol|(R)-(-)-Gossypol|...SMILES: CC1=CC2=C(C(=C(C(=C2C(C)C)O)O)C=O)C(=C1C3=C(C4=C(C=C3C)C(=C(C(=C4C=O)O)O)C(C)C)O)OInChIKey: QBKSWRVVCFFDOT-UHFFFAOYSA-NInChI: InChI=1S/C30H30O8/c1-11(2)19-15-7-13(5)21(27(35)23(15)17(9-31)25(33)29(19)37)22-14(6)8-16-20(12(3)4)30(38)26(34)18(10-32)24(16)28(22)36/h7-12,33-38H,1-6H3
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Ponceau SX
Cas Number: 4548-53-2Formula: C18H14N2Na2O7S2Molecular weight: 480.42Synonyms: 12101 Red | FD&C Red No. 4 | Usacert Red No. 4 | FDC RED NO. 4 | FT-0635358 | 1016649-45-8 | D91976 ...SMILES: CC1=CC(=C(C=C1N=NC2=C(C3=CC=CC=C3C(=C2)S(=O)(=O)[O-])O)S(=O)(=O)[O-])C.[Na+].[Na+]InChIKey: ONTQJDKFANPPKK-UHFFFAOYSA-LInChI: InChI=1S/C18H16N2O7S2.2Na/c1-10-7-11(2)16(28(22,23)24)8-14(10)19-20-15-9-17(29(25,26)27)12-5-3-4-6-13(12)18(15)21;;/h3-9,21H,1-2H3,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2
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