| CAS Number | 1311315-27-1 |
| Catalog Number | AG01AIV4(AGN-PC-0WOTPJ) |
| Chemical Name | 7-(trifluoromethyl)-2-azabicyclo[4.1.0]heptane hydrochloride |
| IUPAC Name | 7-(trifluoromethyl)-2-azabicyclo[4.1.0]heptane;hydrochloride |
| InChI | InChI=1S/C7H10F3N.ClH/c8-7(9,10)5-4-2-1-3-11-6(4)5;/h4-6,11H,1-3H2;1H |
| InChI Key | PCZLFRMXTFKADK-UHFFFAOYSA-N |
| MDL Number | MFCD18917404 |
| Molecular Formula | C7H11ClF3N |
| Molecular Weight | 201.6171 |
| SMILES | Cl.FC(C1C2C1CCCN2)(F)F |
| Synonyms | 7-(trifluoromethyl)-2-azabicyclo[4.1.0]heptane hydrochloride,
1311315-27-1,
AKOS026743301,
NE53724,
EN300-79100,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.617g/mol |
| Monoisotopic Mass | 201.053g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 3 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number