| CAS Number | 1169952-82-2 |
| Catalog Number | AG019MYA(AGN-PC-06V8D9) |
| Chemical Name | N-(2,2,2-Trifluoroethyl)cyclopropanamine hydrochloride |
| IUPAC Name | N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride |
| InChI | InChI=1S/C5H8F3N.ClH/c6-5(7,8)3-9-4-1-2-4;/h4,9H,1-3H2;1H |
| InChI Key | XNUIOISZOAAVDE-UHFFFAOYSA-N |
| MDL Number | MFCD11099589 |
| Molecular Formula | C5H9ClF3N |
| Molecular Weight | 175.5799 |
| SMILES | Cl.FC(CNC1CC1)(F)F |
| Synonyms | N-(2,2,2-trifluoroethyl)cyclopropanamine hydrochloride,
1169952-82-2,
AC1Q3C8T,
CTK7B7180,
AKOS026742272,
MCULE-2044591187,
NE14883,
SC-34585,
EN300-38924,
J-003489,
Z803145464,
N-(2,2,2-TRIFLUOROETHYL)CYCLOPROPANAMINE HYDROCHLO,
|
| Complexity | 94.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.579g/mol |
| Monoisotopic Mass | 175.038g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number