| CAS Number | 1209685-75-5 |
| Catalog Number | AG0099TW |
| Chemical Name | (1-(4-(Trifluoromethoxy)phenyl)cyclopropyl)methanamine hydrochloride |
| IUPAC Name | [1-[4-(trifluoromethoxy)phenyl]cyclopropyl]methanamine;hydrochloride |
| InChI | InChI=1S/C11H12F3NO.ClH/c12-11(13,14)16-9-3-1-8(2-4-9)10(7-15)5-6-10;/h1-4H,5-7,15H2;1H |
| InChI Key | BDOZXLHIVFHDKW-UHFFFAOYSA-N |
| MDL Number | MFCD13619673 |
| Molecular Formula | C11H13ClF3NO |
| Molecular Weight | 267.6752 |
| SMILES | Cl.NCC1(C2=CC=C(OC(F)(F)F)C=C2)CC1 |
| Synonyms | 1209685-75-5,
(1-(4-(trifluoromethoxy)phenyl)cyclopropyl)methanamine hydrochloride,
DTXSID40672624,
MFCD13619673,
AKOS027384378,
PC404541,
T6298,
1-{1-[4-(Trifluoromethoxy)phenyl]cyclopropyl}methanamine--hydrogen chloride (1/1),
BDOZXLHIVFHDKW-UHFFFAOYSA-N,
|
| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.676g/mol |
| Monoisotopic Mass | 267.064g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number