| CAS Number | 1516118-44-7 |
| Catalog Number | AG01C5EJ |
| Chemical Name | 1-(1-ethyl-1H-1,2,3-triazol-4-yl)ethan-1-ol |
| IUPAC Name | 1-(1-ethyltriazol-4-yl)ethanol |
| InChI | InChI=1S/C6H11N3O/c1-3-9-4-6(5(2)10)7-8-9/h4-5,10H,3H2,1-2H3 |
| InChI Key | IOXDCTNWEYQHIA-UHFFFAOYSA-N |
| MDL Number | MFCD23572000 |
| Molecular Formula | C6H11N3O |
| Molecular Weight | 141.1710 |
| SMILES | CCN1N=NC(C(O)C)=C1 |
| Synonyms | 1-(1-ethyl-1H-1,2,3-triazol-4-yl)ethan-1-ol,
1516118-44-7,
AKOS020022101,
|
| Complexity | 109 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 141.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 141.174g/mol |
| Monoisotopic Mass | 141.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number