Vitas-M small molecule compound
3-(2-carboxyethyl)-5,6-dichloro-1,2-dimethyl-1H-benzimidazol-3-ium
Catalog ID
STL363183
SMILES Cc1n(C)c2c([n+]1CCC(=O)O)cc(c(c2)Cl)Cl
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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 C12H13Cl2N2O2 MW 288.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12Cl2N2O2/c1-7-15(2)10-5-8(13)9(14)6-11(10)16(7)4-3-12(17)18/h5-6H,3-4H2,1-2H3/p+1InChIKey
CANGXHHWEICHPF-UHFFFAOYSA-OSynonyms
1(2CARBOXYETHYL)56DICHLORO23DIMETHYL3HBENZOIMIDAZOL1IUM
3(2carboxyethyl)56dichloro12dimethyl1Hbenzimidazol3ium
3(56DICHLORO23DIMETHYLBENZIMIDAZOL3IUM1YL)PROPANOICACID
CC1=(N+)(C2=CC(=C(C=C2N1CCC(=O)O)Cl)Cl)C
Cc1n(C)c2c((n+)1CCC(=O)O)cc(c(c2)Cl)Cl
InChI=1SC12H12Cl2N2O2c1715(2)1058(13)9(14)611(10)16(7)4312(17)18h56H34H212H3p+1
MFCD00602384
ZINC000004792849
ZINC4792849
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