| CAS Number | 1423033-71-9 |
| Catalog Number | AG01A2MZ(AGN-PC-0WO7WZ) |
| Chemical Name | (3,5-diethyl-1-methyl-1H-pyrazol-4-yl)methanamine |
| IUPAC Name | (3,5-diethyl-1-methylpyrazol-4-yl)methanamine |
| InChI | InChI=1S/C9H17N3/c1-4-8-7(6-10)9(5-2)12(3)11-8/h4-6,10H2,1-3H3 |
| InChI Key | XYTONGZCTYIPTQ-UHFFFAOYSA-N |
| MDL Number | MFCD21828502 |
| Molecular Formula | C9H17N3 |
| Molecular Weight | 167.2514 |
| SMILES | CCC1C(CN)=C(CC)N(C)N=1 |
| Synonyms | (3,5-diethyl-1-methyl-1H-pyrazol-4-yl)methanamine,
1423033-71-9,
ZINC83255324,
AKOS017771429,
MCULE-8919929609,
NE16778,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.256g/mol |
| Monoisotopic Mass | 167.142g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number