| CAS Number | 1260658-79-4 |
| Catalog Number | AG01AOLJ(AGN-PC-0WBD91) |
| Chemical Name | (1-cyclopentyl-1H-pyrazol-3-yl)methanol |
| IUPAC Name | (1-cyclopentylpyrazol-3-yl)methanol |
| InChI | InChI=1S/C9H14N2O/c12-7-8-5-6-11(10-8)9-3-1-2-4-9/h5-6,9,12H,1-4,7H2 |
| InChI Key | JRHLPBZLJUHMAZ-UHFFFAOYSA-N |
| MDL Number | MFCD18262423 |
| Molecular Formula | C9H14N2O |
| Molecular Weight | 166.2203 |
| SMILES | OCC1=NN(C2CCCC2)C=C1 |
| Synonyms | (1-Cyclopentyl-1H-pyrazol-3-yl)methanol,
1260658-79-4,
MFCD18262423,
SBB073690,
ZINC72209569,
AKOS005169431,
MCULE-6019749358,
(1-cyclopentylpyrazol-3-yl)methan-1-ol,
|
| Complexity | 146 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.224g/mol |
| Monoisotopic Mass | 166.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number