Vitas-M small molecule compound

3-(ethoxycarbonyl)-4,5-dimethyl-1H-pyrrole-2-carboxylic acid

Catalog ID
STK408822
SMILES CCOC(=O)c1c([nH]c(c1C)C)C(=O)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C10H13NO4 MW 211.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H13NO4/c1-4-15-10(14)7-5(2)6(3)11-8(7)9(12)13/h11H,4H2,1-3H3,(H,12,13)
InChIKey
AZOFTYGLXBYICQ-UHFFFAOYSA-N
Synonyms
63900-79-8
1HPYRROLE23DICARBOXYLICACID45DIMETHYL3ETHYLESTER
3(ethoxycarbonyl)45dimethyl1Hpyrrole2carboxylicacid
3ETHOXYCARBONYL45DIMETHYL1HPYRROLE2CARBOXYLICACID
63900798
CCOC(=O)C1=C(NC(=C1C)C)C(=O)O
CCOC(=O)c1c((nH)c(c1C)C)C(=O)O
InChI=1SC10H13NO4c141510(14)75(2)6(3)118(7)9(12)13h11H4H213H3(H1213)
MFCD00030416
ZINC000001595864
ZINC1595864

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.