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Pyrrole 2-carboxylic acids
Description:
Pyrrole carboxylic acids where the carboxyl group is attached at position C2.
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5-(Methoxycarbonyl)-1H-pyrrole-2-carboxylic acidCas Number: 1199-64-0Formula: C7H7NO4 Molecular Weight: 169.13SMILES: COC(=O)C1=CC=C(N1)C(=O)OInChIKey: RSCFOPAKJCCZNX-UHFFFAOYSA-NInChI: InChI=1S/C7H7NO4/c1-12-7(11)5-3-2-4(8-5)6(9)10/h2-3,8H,1H3,(H,9,10) -
5-Isopropyl-1H-pyrrole-2-carboxylic acidCas Number: 90607-16-2 Compound CID: 45082075Formula: C8H11NO2 Molecular Weight: 153.18IUPAC Name: 5-propan-2-yl-1H-pyrrole-2-carboxylic acidSMILES: CC(C)C1=CC=C(N1)C(=O)OInChIKey: RUVJYWIINMYEAQ-UHFFFAOYSA-NInChI: InChI=1S/C8H11NO2/c1-5(2)6-3-4-7(9-6)8(10)11/h3-5,9H,1-2H3,(H,10,11)
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5-Formyl-1H-pyrrole-2-carboxylic acidCas Number: 7126-51-4 Compound CID: 15160089Formula: C6H5NO3IUPAC Name: 5-formyl-1H-pyrrole-2-carboxylic acidSMILES: C1=C(NC(=C1)C(=O)O)C=OInChIKey: RHYXVCZQDGPFBX-UHFFFAOYSA-NInChI: InChI=1S/C6H5NO3/c8-3-4-1-2-5(7-4)6(9)10/h1-3,7H,(H,9,10)
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4，5-Dichloro-1H-pyrrole-2-carboxylic acidCas Number: 39209-94-4 Compound CID: 16227494IUPAC Name: 4,5-dichloro-1H-pyrrole-2-carboxylic acidSMILES: C1=C(NC(=C1Cl)Cl)C(=O)OInChIKey: MNMMKOBJLQMWLQ-UHFFFAOYSA-NInChI: InChI=1S/C5H3Cl2NO2/c6-2-1-3(5(9)10)8-4(2)7/h1,8H,(H,9,10)
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4-Formyl-1H-pyrrole-2-carboxylicacidCas Number: 7126-53-6 Compound CID: 13780813Formula: C6H5NO3 Molecular Weight: 139.11IUPAC Name: 4-formyl-1H-pyrrole-2-carboxylic acidSMILES: C1=C(NC=C1C=O)C(=O)OInChIKey: IGQGTSFYIOGZRK-UHFFFAOYSA-NInChI: InChI=1S/C6H5NO3/c8-3-4-1-5(6(9)10)7-2-4/h1-3,7H,(H,9,10)
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3，4-Dichloro-5-methyl-1H-pyrrole-2-carboxylic acidCas Number: 24691-30-3 Compound CID: 25137682Formula: C6H5Cl2NO2 Molecular Weight: 194.01IUPAC Name: 3,4-dichloro-5-methyl-1H-pyrrole-2-carboxylic acidSMILES: CC1=C(C(=C(N1)C(=O)O)Cl)ClInChIKey: HIXZMJPBUJFSPJ-UHFFFAOYSA-NInChI: InChI=1S/C6H5Cl2NO2/c1-2-3(7)4(8)5(9-2)6(10)11/h9H,1H3,(H,10,11)
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4,5-Dibromo-1H-pyrrole-2-carboxylic acidCas Number: 34649-21-3Formula: C5H3Br2NO2 Molecular Weight: 268.89IUPAC Name: 4,5-dibromo-1H-pyrrole-2-carboxylic acidSMILES: C1=C(NC(=C1Br)Br)C(=O)OInChIKey: ZUROCNHARMFRKA-UHFFFAOYSA-NInChI: InChI=1S/C5H3Br2NO2/c6-2-1-3(5(9)10)8-4(2)7/h1,8H,(H,9,10)
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4-Formyl-3，5-dimethyl-1H-pyrrole-2-carboxylic acidCas Number: 17120-26-2 Compound CID: 687898Formula: C8H9NO3 Molecular Weight: 167.16IUPAC Name: 4-formyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acidSMILES: CC1=C(NC(=C1C=O)C)C(=O)OInChIKey: ATIAZNFYOJDAIO-UHFFFAOYSA-NInChI: InChI=1S/C8H9NO3/c1-4-6(3-10)5(2)9-7(4)8(11)12/h3,9H,1-2H3,(H,11,12)
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4-Ethoxycarbonyl-3,5-dimethylpyrrole-2-carboxylic acidCas Number: 5442-91-1 Compound CID: 224709Formula: C10H13NO4 Molecular Weight: 211.22IUPAC Name: 4-ethoxycarbonyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acidSMILES: CCOC(=O)C1=C(NC(=C1C)C(=O)O)CInChIKey: DXKYHAPIBYYLJR-UHFFFAOYSA-NInChI: InChI=1S/C10H13NO4/c1-4-15-10(14)7-5(2)8(9(12)13)11-6(7)3/h11H,4H2,1-3H3,(H,12,13)Synonyms: 4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate | 4-(Ethoxycarbonyl)-3,5-dimethyl-1h-pyrrole-2-carboxylic acid
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3,5-Dimethyl-1H-pyrrole-2,4-dicarboxylic acidCas Number: 5434-29-7 Compound CID: 225903Formula: C8H9NO4 Molecular Weight: 183.17IUPAC Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acidSMILES: CC1=C(NC(=C1C(=O)O)C)C(=O)OInChIKey: LGAFIBCWNKPENX-UHFFFAOYSA-NInChI: InChI=1S/C8H9NO4/c1-3-5(7(10)11)4(2)9-6(3)8(12)13/h9H,1-2H3,(H,10,11)(H,12,13)Synonyms: 3,5-dimethyl-pyrrole-2,4-dicarboxylic acid | 3,5-Dimethyl-pyrrol-2,4-dicarbonsaeure
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1H-Pyrrole-2，3-dicarboxylic acidCas Number: 1125-32-2 Compound CID: 150884Formula: C6H5NO4 Molecular Weight: 155.11IUPAC Name: 1H-pyrrole-2,3-dicarboxylic acidSMILES: C1=CNC(=C1C(=O)O)C(=O)OInChIKey: OEUSNWDYXDEXDR-UHFFFAOYSA-NInChI: InChI=1S/C6H5NO4/c8-5(9)3-1-2-7-4(3)6(10)11/h1-2,7H,(H,8,9)(H,10,11)
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5-cyano-1H-pyrrole-2-carboxylic acidCas Number: 854044-30-7 Compound CID: 55302753Formula: C6H4N2O2 Molecular Weight: 136.11SMILES: C1=C(NC(=C1)C(=O)O)C#NInChIKey: RCODEPXKMGSYIA-UHFFFAOYSA-NInChI: InChI=1S/C6H4N2O2/c7-3-4-1-2-5(8-4)6(9)10/h1-2,8H,(H,9,10)
