| CAS Number | 929971-61-9 |
| Catalog Number | AG019M5C |
| Chemical Name | 3-({6-methylimidazo[1,2-a]pyridin-2-yl}methoxy)benzoic acid |
| IUPAC Name | 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoic acid |
| InChI | InChI=1S/C16H14N2O3/c1-11-5-6-15-17-13(9-18(15)8-11)10-21-14-4-2-3-12(7-14)16(19)20/h2-9H,10H2,1H3,(H,19,20) |
| InChI Key | IKVWRNDUJLGJGU-UHFFFAOYSA-N |
| MDL Number | MFCD09040620 |
| Molecular Formula | C16H14N2O3 |
| Molecular Weight | 282.2940 |
| SMILES | CC1=CN2C(=NC(=C2)COC2=CC(C(O)=O)=CC=C2)C=C1 |
| Synonyms | 3-({6-methylimidazo[1,2-a]pyridin-2-yl}methoxy)benzoic acid,
929971-61-9,
3-[(6-METHYLIMIDAZO[1,2-A]PYRIDIN-2-YL)METHOXY]BENZOIC ACID,
AC1Q2OJ8,
CTK6C0774,
ZINC8725239,
AKOS008970798,
MCULE-6150104620,
NE20792,
EN300-34773,
Z64740181,
|
| Complexity | 377 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 282.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 282.299g/mol |
| Monoisotopic Mass | 282.1g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 63.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number