| CAS Number | 1694855-13-4 |
| Catalog Number | AG00HZBH(AGN-PC-0WQZTA) |
| Chemical Name | 2-CHloro-4-(imidazol-1-yl)benzyl alcohol |
| IUPAC Name | (2-chloro-4-imidazol-1-ylphenyl)methanol |
| InChI | InChI=1S/C10H9ClN2O/c11-10-5-9(2-1-8(10)6-14)13-4-3-12-7-13/h1-5,7,14H,6H2 |
| InChI Key | LVPPYUHSGBSFHZ-UHFFFAOYSA-N |
| MDL Number | MFCD30527642 |
| Molecular Formula | C10H9ClN2O |
| Molecular Weight | 208.6443 |
| SMILES | C1=CC(=C(C=C1N2C=CN=C2)Cl)CO |
| Synonyms | 2-Chloro-4-(imidazol-1-yl)benzyl alcohol,
1694855-13-4,
|
| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.645g/mol |
| Monoisotopic Mass | 208.04g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number