| CAS Number | 43002-56-8 |
| Catalog Number | AG01E945(AGN-PC-0OADL1) |
| Chemical Name | (2-benzyl-1H-imidazol-4-yl)methanol |
| IUPAC Name | (2-benzyl-1H-imidazol-5-yl)methanol |
| InChI | InChI=1S/C11H12N2O/c14-8-10-7-12-11(13-10)6-9-4-2-1-3-5-9/h1-5,7,14H,6,8H2,(H,12,13) |
| InChI Key | XMKYXMNRMGDDGL-UHFFFAOYSA-N |
| MDL Number | MFCD27950718 |
| Molecular Formula | C11H12N2O |
| Molecular Weight | 188.2258 |
| SMILES | OCC1N=C(CC2=CC=CC=C2)NC=1 |
| Synonyms | (2-benzyl-1H-imidazol-4-yl)methanol,
43002-56-8,
1H-Imidazole-5-methanol, 2-(phenylmethyl)-,
2-benzyl-4-imidazolemethanol,
SCHEMBL4450908,
XMKYXMNRMGDDGL-UHFFFAOYSA-N,
ZINC39369387,
AKOS012409167,
Z2583036222,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.23g/mol |
| Monoisotopic Mass | 188.095g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 48.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number