Vitas-M small molecule compound

5-ethoxy-1H-benzimidazole-2-sulfonic acid

Catalog ID
STK498434
SMILES CCOc1ccc2c(c1)nc([nH]2)S(=O)(=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 C9H10N2O4S MW 242.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H10N2O4S/c1-2-15-6-3-4-7-8(5-6)11-9(10-7)16(12,13)14/h3-5H,2H2,1H3,(H,10,11)(H,12,13,14)
InChIKey
ZJBCFDFJDUTQLB-UHFFFAOYSA-N
Synonyms
301163-44-0
301163440
5ethoxy1Hbenzimidazole2sulfonicacid
5ETHOXY1HBENZOIMIDAZOLE2SULFONICACID
5ETHOXYBENZIMIDAZOLE2SULFONICACID
6ETHOXY1HBENZIMIDAZOLE2SULFONICACID
CCOC1=CC2=C(C=C1)N=C(N2)S(=O)(=O)O
CCOc1ccc2c(c1)nc((nH)2)S(=O)(=O)O
InChI=1SC9H10N2O4Sc121563478(56)119(107)16(1213)14h35H2H21H3(H1011)(H121314)
MFCD00965564
ZINC000006458637
ZINC6458637

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Available files

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