| CAS Number | 861135-89-9 |
| Catalog Number | AG01EA74 |
| Chemical Name | (1-tert-butyl-1H-pyrazol-4-yl)methanol |
| IUPAC Name | (1-tert-butylpyrazol-4-yl)methanol |
| InChI | InChI=1S/C8H14N2O/c1-8(2,3)10-5-7(6-11)4-9-10/h4-5,11H,6H2,1-3H3 |
| InChI Key | LLFDPQHSIQKDQD-UHFFFAOYSA-N |
| MDL Number | MFCD11840198 |
| Molecular Formula | C8H14N2O |
| Molecular Weight | 154.2096 |
| SMILES | CC(N1N=CC(CO)=C1)(C)C |
| Synonyms | SCHEMBL3765275,
LLFDPQHSIQKDQD-UHFFFAOYSA-N,
AKOS009940523,
(1-t-butyl-1H-pyrazol-4-yl)methanol,
861135-89-9,
(1-tert-butyl-1h-pyrazol-4-yl)methanol,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.213g/mol |
| Monoisotopic Mass | 154.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number