| CAS Number | 75242-69-2 |
| Catalog Number | AG019YLZ(AGN-PC-0U6WBP) |
| Chemical Name | 1-(1H-pyrazol-1-yl)propan-2-ol |
| IUPAC Name | 1-pyrazol-1-ylpropan-2-ol |
| InChI | InChI=1S/C6H10N2O/c1-6(9)5-8-4-2-3-7-8/h2-4,6,9H,5H2,1H3 |
| InChI Key | VPFGKEVDZXXQAV-UHFFFAOYSA-N |
| MDL Number | MFCD04971030 |
| Molecular Formula | C6H10N2O |
| Molecular Weight | 126.1564 |
| SMILES | CC(CN1N=CC=C1)O |
| Synonyms | 1-(1H-pyrazol-1-yl)propan-2-ol,
75242-69-2,
1-pyrazolylpropan-2-ol,
SCHEMBL11189962,
CTK6A8406,
1-(2-Hydroxypropyl)-1H-pyrazole,
MFCD04971030,
SBB022477,
STK349831,
AKOS000311091,
MCULE-6657853824,
NE13002,
ST45127954,
Z1359429504,
|
| Complexity | 87.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 126.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 126.159g/mol |
| Monoisotopic Mass | 126.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number