| CAS Number | 1416439-44-5 |
| Catalog Number | AG01B231 |
| Chemical Name | 1-(2-(Trifluoromethyl)phenyl)cyclobutanamine hydrochloride |
| IUPAC Name | 1-[2-(trifluoromethyl)phenyl]cyclobutan-1-amine;hydrochloride |
| InChI | InChI=1S/C11H12F3N.ClH/c12-11(13,14)9-5-2-1-4-8(9)10(15)6-3-7-10;/h1-2,4-5H,3,6-7,15H2;1H |
| InChI Key | KIOQKOXLQMDDLN-UHFFFAOYSA-N |
| MDL Number | MFCD17392718 |
| Molecular Formula | C11H13ClF3N |
| Molecular Weight | 251.6758 |
| SMILES | Cl.NC1(C2=C(C(F)(F)F)C=CC=C2)CCC1 |
| Synonyms | 1416439-44-5,
1-(2-(Trifluoromethyl)phenyl)cyclobutanamine hydrochloride,
1-[2-(TRIFLUOROMETHYL)PHENYL]CYCLOBUTAN-1-AMINE HCL,
1-[2-(trifluoromethyl)phenyl]cyclobutan-1-amine hydrochloride,
1-[2-(Trifluoromethyl)phenyl]cyclobutanamine hydrochloride,
SCHEMBL18742640,
AKOS027251314,
KS-9018,
1314785-94-8,
|
| Complexity | 233 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.677g/mol |
| Monoisotopic Mass | 251.069g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number