| CAS Number | 53292-71-0 |
| Catalog Number | AG01C460(AGN-PC-0WC5QW) |
| Chemical Name | 4-Hydroxymethyl-2-pyridin-2-yl-3H-imidazole |
| IUPAC Name | (2-pyridin-2-yl-1H-imidazol-5-yl)methanol |
| InChI | InChI=1S/C9H9N3O/c13-6-7-5-11-9(12-7)8-3-1-2-4-10-8/h1-5,13H,6H2,(H,11,12) |
| InChI Key | YOFNCIVLJRZUKE-UHFFFAOYSA-N |
| MDL Number | MFCD10568331 |
| Molecular Formula | C9H9N3O |
| Molecular Weight | 175.1873 |
| SMILES | OCC1NC(C2=NC=CC=C2)=NC=1 |
| Synonyms | 4-Hydroxymethyl-2-pyridin-2-yl-3H-imidazole,
53292-71-0,
[2-(pyridin-2-yl)-1H-imidazol-5-yl]methanol,
(2-(Pyridin-2-yl)-1H-imidazol-5-yl)methanol,
SCHEMBL19691749,
CTK8A3180,
KS-00003H1J,
MFCD10568331,
SBB089052,
ZINC91696210,
AKOS012409240,
AKOS015856516,
AS-5444,
(2-(2-pyridyl)imidazol-5-yl)methan-1-ol,
TR-072089,
[2-(2-Pyridinyl)-1H-imidazol-4-yl]methanol,
[2-(pyridin-2-yl)-1H-imidazol-4-yl]methanol,
[2-(pyridin-2-yl)-3H-imidazol-4-yl]methanol,
Z2429425653,
[2-(2-Pyridinyl)-1H-imidazol-4-yl]methanol, AldrichCPR,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.191g/mol |
| Monoisotopic Mass | 175.075g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 61.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number