| CAS Number | 1094415-91-4 |
| Catalog Number | AG019PNJ(AGN-PC-0WO1O8) |
| Chemical Name | [1-(difluoromethyl)-1H-imidazol-2-yl]methanamine |
| IUPAC Name | [1-(difluoromethyl)imidazol-2-yl]methanamine |
| InChI | InChI=1S/C5H7F2N3/c6-5(7)10-2-1-9-4(10)3-8/h1-2,5H,3,8H2 |
| InChI Key | RAGHSYAOFYWRGW-UHFFFAOYSA-N |
| MDL Number | MFCD13358357 |
| Molecular Formula | C5H7F2N3 |
| Molecular Weight | 147.1260 |
| SMILES | NCC1N(C(F)F)C=CN=1 |
| Synonyms | [1-(difluoromethyl)-1H-imidazol-2-yl]methanamine,
1094415-91-4,
(1-(difluoromethyl)-1H-imidazol-2-yl)methanamine,
SCHEMBL16198470,
RAGHSYAOFYWRGW-UHFFFAOYSA-N,
ZINC36804813,
AKOS008077273,
MCULE-5238615483,
NE20208,
EN300-24494,
Z1267881972,
|
| Complexity | 109 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.129g/mol |
| Monoisotopic Mass | 147.061g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number