| CAS Number | 1031619-96-1 |
| Catalog Number | AG0095JT(AGN-PC-0WAXUG) |
| Chemical Name | 3-chloro-N-cyclopropyl-5-(trifluoromethyl)pyridin-2-amine |
| IUPAC Name | 3-chloro-N-cyclopropyl-5-(trifluoromethyl)pyridin-2-amine |
| InChI | InChI=1S/C9H8ClF3N2/c10-7-3-5(9(11,12)13)4-14-8(7)15-6-1-2-6/h3-4,6H,1-2H2,(H,14,15) |
| InChI Key | TZSCHGJUVRRQMA-UHFFFAOYSA-N |
| MDL Number | MFCD11117304 |
| Molecular Formula | C9H8ClF3N2 |
| Molecular Weight | 236.6214 |
| SMILES | ClC1(=C(N=CC(=C1)C(F)(F)F)NC2(CC2)) |
| Synonyms | 1031619-96-1,
3-chloro-N-cyclopropyl-5-(trifluoromethyl)pyridin-2-amine,
N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-cyclopropylamine,
CTK6G7011,
KS-00001PTU,
3-Chloro-2-(cyclopropylamino)-5-(trifluoromethyl)pyridine,
HMS3437I11,
MFCD11117304,
SBB098657,
ZINC20545605,
AKOS005071536,
AD-0733,
AM86228,
MCULE-2271077611,
RP13594,
AJ-77857,
chlorotrifluoromethylpyridinylcyclopropylamine,
AB01005688-01,
Z31232839,
[3-chloro-5-(trifluoromethyl)(2-pyridyl)]cyclopropylamine,
N-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]cyclopropylamine,
|
| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.622g/mol |
| Monoisotopic Mass | 236.033g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number