| CAS Number | 325153-01-3 |
| Catalog Number | AG00CMWV |
| Chemical Name | b-AMino-2-(trifluoroMethyl)benzeneethanol |
| IUPAC Name | 2-amino-2-[2-(trifluoromethyl)phenyl]ethanol |
| InChI | InChI=1S/C9H10F3NO/c10-9(11,12)7-4-2-1-3-6(7)8(13)5-14/h1-4,8,14H,5,13H2 |
| InChI Key | OIRSHTSIVLNGMS-UHFFFAOYSA-N |
| MDL Number | MFCD11106295 |
| Molecular Formula | C9H10F3NO |
| Molecular Weight | 205.1770 |
| SMILES | c1ccc(c(c1)C(CO)N)C(F)(F)F |
| Synonyms | 2-amino-2-[2-(trifluoromethyl)phenyl]ethan-1-ol,
2-amino-2-(2-(trifluoromethyl)phenyl)ethan-1-ol,
SCHEMBL10216843,
OIRSHTSIVLNGMS-UHFFFAOYSA-N,
AKOS005265723,
BS-9733,
KS-000023K8,
325153-01-3,
2-amino-2-[2-(trifluoromethyl)phenyl]ethanol,
(R)-2-AMINO-2-(2-(TRIFLUOROMETHYL)PHENYL)ETHAN-1-OL,
(S)-2-AMINO-2-(2-(TRIFLUOROMETHYL)PHENYL)ETHAN-1-OL,
1213078-55-7,
b-Amino-2-(trifluoromethyl)benzeneethanol,
(2R)-2-AMINO-2-[2-(TRIFLUOROMETHYL)PHENYL]ETHAN-1-OL,
(2S)-2-AMINO-2-[2-(TRIFLUOROMETHYL)PHENYL]ETHAN-1-OL,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.18g/mol |
| Monoisotopic Mass | 205.071g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number