| CAS Number | 30433-58-0 |
| Catalog Number | AG00I5PQ(AGN-PC-0WBPH2) |
| Chemical Name | 3-Ethyl-1-methyl-1H-pyrazole |
| IUPAC Name | 3-ethyl-1-methylpyrazole |
| InChI | InChI=1S/C6H10N2/c1-3-6-4-5-8(2)7-6/h4-5H,3H2,1-2H3 |
| InChI Key | ZAXITHHHFYZUGN-UHFFFAOYSA-N |
| MDL Number | MFCD08701123 |
| Molecular Formula | C6H10N2 |
| Molecular Weight | 110.1570 |
| SMILES | CCC1=NN(C)C=C1 |
| Synonyms | 3-Ethyl-1-methyl-1H-pyrazole,
30433-58-0,
1-methyl-3-ethylpyrazole,
SCHEMBL256698,
1H-pyrazole, 3-ethyl-1-methyl-,
ALBB-018405,
MFCD08701123,
ZINC26547541,
AKOS003673810,
T0354,
|
| Complexity | 72.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 110.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 110.16g/mol |
| Monoisotopic Mass | 110.084g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number