| CAS Number | 1177358-72-3 |
| Catalog Number | AG008VF8(AGN-PC-0WB3WW) |
| Chemical Name | 2-Methyl-2-(1H-pyrazol-1-yl)propan-1-ol |
| IUPAC Name | 2-methyl-2-pyrazol-1-ylpropan-1-ol |
| InChI | InChI=1S/C7H12N2O/c1-7(2,6-10)9-5-3-4-8-9/h3-5,10H,6H2,1-2H3 |
| InChI Key | WDZAGJXERQJBAE-UHFFFAOYSA-N |
| MDL Number | MFCD11505285 |
| Molecular Formula | C7H12N2O |
| Molecular Weight | 140.1830 |
| SMILES | N1(C=CC=N1)C(C)(C)CO |
| Synonyms | 1177358-72-3,
2-Methyl-2-(1H-pyrazol-1-yl)propan-1-ol,
2-METHYL-2-(1H-PYRAZOL-1-YL)-1-PROPANOL,
SCHEMBL11170967,
DTXSID60651996,
MFCD11505285,
ZINC21953174,
AKOS006323344,
AJ-78716,
DA-15007,
FT-0742083,
Y-6735,
2-methyl-2-(1H-pyrazol-1-yl)-1-propanol(SALTDATA,
Z2515207596,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 140.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.186g/mol |
| Monoisotopic Mass | 140.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number