| CAS Number | 1384428-09-4 |
| Catalog Number | AG019Z4B(AGN-PC-0WOCC2) |
| Chemical Name | 1-(1-phenyl-1H-1,2,3-triazol-4-yl)ethan-1-ol |
| IUPAC Name | 1-(1-phenyltriazol-4-yl)ethanol |
| InChI | InChI=1S/C10H11N3O/c1-8(14)10-7-13(12-11-10)9-5-3-2-4-6-9/h2-8,14H,1H3 |
| InChI Key | FQVMGHGOWXLPQW-UHFFFAOYSA-N |
| MDL Number | MFCD22369838 |
| Molecular Formula | C10H11N3O |
| Molecular Weight | 189.2138 |
| SMILES | CC(C1N=NN(C2=CC=CC=C2)C=1)O |
| Synonyms | 1-(1-phenyl-1H-1,2,3-triazol-4-yl)ethan-1-ol,
1384428-09-4,
SCHEMBL9634370,
AKOS018559761,
MCULE-1534095858,
NE17433,
|
| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.218g/mol |
| Monoisotopic Mass | 189.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number