| CAS Number | 929975-41-7 |
| Catalog Number | AG019KGH |
| Chemical Name | 2-[({6-methylimidazo[1,2-a]pyridin-2-yl}methyl)sulfanyl]acetic acid |
| IUPAC Name | 2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]acetic acid |
| InChI | InChI=1S/C11H12N2O2S/c1-8-2-3-10-12-9(5-13(10)4-8)6-16-7-11(14)15/h2-5H,6-7H2,1H3,(H,14,15) |
| InChI Key | OEMCOZVHEFNSMU-UHFFFAOYSA-N |
| MDL Number | MFCD09040431 |
| Molecular Formula | C11H12N2O2S |
| Molecular Weight | 236.2902 |
| SMILES | CC1=CN2C(=NC(=C2)CSCC(O)=O)C=C1 |
| Synonyms | 2-[({6-methylimidazo[1,2-a]pyridin-2-yl}methyl)sulfanyl]acetic acid,
929975-41-7,
{[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thio}acetic acid,
AC1Q2OJA,
CTK7J5890,
ZINC8754332,
AKOS009115814,
MCULE-7617857062,
NE30911,
EN300-26848,
AB00770581-01,
Z235343027,
Acetic acid, 2-[[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]thio],
|
| Complexity | 262 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.289g/mol |
| Monoisotopic Mass | 236.062g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 79.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number