| CAS Number | 1251922-85-6 |
| Catalog Number | AG01AA0K |
| Chemical Name | [1-(2,2-diethoxyethyl)-1H-1,2,3-triazol-4-yl]methanol |
| IUPAC Name | [1-(2,2-diethoxyethyl)triazol-4-yl]methanol |
| InChI | InChI=1S/C9H17N3O3/c1-3-14-9(15-4-2)6-12-5-8(7-13)10-11-12/h5,9,13H,3-4,6-7H2,1-2H3 |
| InChI Key | IFYADEJPZUKXLS-UHFFFAOYSA-N |
| MDL Number | MFCD16817516 |
| Molecular Formula | C9H17N3O3 |
| Molecular Weight | 215.2496 |
| SMILES | CCOC(OCC)CN1N=NC(CO)=C1 |
| Synonyms | [1-(2,2-diethoxyethyl)-1H-1,2,3-triazol-4-yl]methanol,
1251922-85-6,
ZINC57218517,
AKOS033199771,
MCULE-8964968904,
NE28463,
EN300-66715,
Z1259339746,
AC1Q35FG,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.126991g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.25g/mol |
| Monoisotopic Mass | 215.126991g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 69.4Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number