| CAS Number | 449211-78-3 |
| Catalog Number | AG019ELC(AGN-PC-0WG4AU) |
| Chemical Name | (4-(2H-1,2,3-Triazol-2-yl)phenyl)methanol |
| IUPAC Name | [4-(triazol-2-yl)phenyl]methanol |
| InChI | InChI=1S/C9H9N3O/c13-7-8-1-3-9(4-2-8)12-10-5-6-11-12/h1-6,13H,7H2 |
| InChI Key | LSYJFNSQLMNSIH-UHFFFAOYSA-N |
| MDL Number | MFCD30185865 |
| Molecular Formula | C9H9N3O |
| Molecular Weight | 175.1873 |
| SMILES | OCc1ccc(cc1)n1nccn1 |
| Synonyms | (4-[1,2,3]triazol-2-yl-phenyl)-methanol,
449211-78-3,
(4-(2H-1,2,3-Triazol-2-yl)phenyl)methanol,
SCHEMBL3543404,
LSYJFNSQLMNSIH-UHFFFAOYSA-N,
MFCD30185865,
AKOS024056880,
ZINC142247045,
CS-0038943,
(4-[1,2,3]-Triazol-2-yl-phenyl)-methanol,
|
| Complexity | 151 |
| 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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.191g/mol |
| Monoisotopic Mass | 175.075g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number