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Specification
The molecular formula is C10H10N2O2S.
The synonyms are 521320-92-3, Enamine_003468, [(imidazo[1,2-a]pyridin-2-ylmethyl)thio]acetic acid, 2-({imidazo[1,2-a]pyridin-2-ylmethyl}sulfanyl)acetic acid, and HMS1403N14.
The molecular weight is 222.27 g/mol.
It was created on September 18, 2005, and last modified on December 3, 2023.
The IUPAC name is 2-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)acetic acid.
The InChI is InChI=1S/C10H10N2O2S/c13-10(14)7-15-6-8-5-12-4-2-1-3-9(12)11-8/h1-5H,6-7H2,(H,13,14).
The InChIKey is ZMUBWOVMXFJDAC-UHFFFAOYSA-N.
The canonical SMILES is C1=CC2=NC(=CN2C=C1)CSCC(=O)O.
The XLogP3-AA value is 1.8.
It has 4 rotatable bonds.