| CAS Number | 1183104-54-2 |
| Catalog Number | AG019Y9J |
| Chemical Name | 2-Amino-2-(3-(trifluoromethyl)phenyl)propanamide |
| IUPAC Name | 2-amino-2-[3-(trifluoromethyl)phenyl]propanamide |
| InChI | InChI=1S/C10H11F3N2O/c1-9(15,8(14)16)6-3-2-4-7(5-6)10(11,12)13/h2-5H,15H2,1H3,(H2,14,16) |
| InChI Key | UNGTZAKKKXQMGE-UHFFFAOYSA-N |
| MDL Number | MFCD12151859 |
| Molecular Formula | C10H11F3N2O |
| Molecular Weight | 232.2023 |
| SMILES | CC(C1=CC(C(F)(F)F)=CC=C1)(C(N)=O)N |
| Synonyms | 2-amino-2-[3-(trifluoromethyl)phenyl]propanamide,
1183104-54-2,
2-[3-(trifluoromethyl)phenyl]alaninamide,
2-Amino-2-(3-(trifluoromethyl)phenyl)propanamide,
SCHEMBL169141,
UNGTZAKKKXQMGE-UHFFFAOYSA-N,
KS-000023LM,
MFCD12151859,
AKOS010011795,
BS-9785,
MCULE-2049476377,
NE20816,
EN300-100585,
Z1342208362,
2-Amino-2-(3-trifluoromethyl-phenyl)-propionamide,
|
| Complexity | 280 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.206g/mol |
| Monoisotopic Mass | 232.082g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 69.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number