| CAS Number | 929972-67-8 |
| Catalog Number | AG019LB0(AGN-PC-0WO8ZT) |
| Chemical Name | {[1-(difluoromethyl)-1H-imidazol-2-yl]methyl}(methyl)amine |
| IUPAC Name | 1-[1-(difluoromethyl)imidazol-2-yl]-N-methylmethanamine |
| InChI | InChI=1S/C6H9F2N3/c1-9-4-5-10-2-3-11(5)6(7)8/h2-3,6,9H,4H2,1H3 |
| InChI Key | PCACBZDNEUJGCO-UHFFFAOYSA-N |
| MDL Number | MFCD09040727 |
| Molecular Formula | C6H9F2N3 |
| Molecular Weight | 161.1526 |
| SMILES | CNCC1N(C(F)F)C=CN=1 |
| Synonyms | {[1-(difluoromethyl)-1H-imidazol-2-yl]methyl}(methyl)amine,
929972-67-8,
N-{[1-(difluoromethyl)-1H-imidazol-2-yl]methyl}-N-methylamine,
AC1Q417Q,
CTK6I5523,
ZINC19254811,
AKOS000147248,
MCULE-8283082105,
NE14124,
EN300-30649,
Z235582068,
N-([1-(difluoromethyl)-1H-imidazol-2-yl]methyl)-N-Methylamine, AldrichCPR,
([1-(difluoromethyl)-1h-imidazol-2-yl]methyl)(methyl)amine,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 161.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 161.156g/mol |
| Monoisotopic Mass | 161.076g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number