| CAS Number | 1557118-32-7 |
| Catalog Number | AG01B6A1 |
| Chemical Name | N-{1-[3-(trifluoromethyl)phenyl]ethyl}hydroxylamine |
| IUPAC Name | N-[1-[3-(trifluoromethyl)phenyl]ethyl]hydroxylamine |
| InChI | InChI=1S/C9H10F3NO/c1-6(13-14)7-3-2-4-8(5-7)9(10,11)12/h2-6,13-14H,1H3 |
| InChI Key | DEMLQIXIOMGTBA-UHFFFAOYSA-N |
| MDL Number | MFCD24284568 |
| Molecular Formula | C9H10F3NO |
| Molecular Weight | 205.1770 |
| SMILES | CC(C1=CC(C(F)(F)F)=CC=C1)NO |
| Synonyms | N-{1-[3-(trifluoromethyl)phenyl]ethyl}hydroxylamine,
1557118-32-7,
AKOS021002249,
|
| 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 | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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