| CAS Number | 875570-76-6 |
| Catalog Number | AG01C6ZS(AGN-PC-00CUSE) |
| Chemical Name | (3-methoxy-1-methyl-1H-pyrazol-4-yl)methanol |
| IUPAC Name | (3-methoxy-1-methylpyrazol-4-yl)methanol |
| InChI | InChI=1S/C6H10N2O2/c1-8-3-5(4-9)6(7-8)10-2/h3,9H,4H2,1-2H3 |
| InChI Key | INMQDURGNQFXFO-UHFFFAOYSA-N |
| MDL Number | MFCD16620639 |
| Molecular Formula | C6H10N2O2 |
| Molecular Weight | 142.1558 |
| SMILES | COC1C(CO)=CN(C)N=1 |
| Synonyms | (3-methoxy-1-methyl-1H-pyrazol-4-yl)methanol,
875570-76-6,
ZINC136868487,
1-Methyl-3-methoxy-1H-pyrazole-4-methanol,
1H-Pyrazole-4-methanol, 3-methoxy-1-methyl-,
CID11622348,
(3-methoxy-1-methyl-pyrazol-4-yl)methanol,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.158g/mol |
| Monoisotopic Mass | 142.074g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 47.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number