| CAS Number | 59667-20-8 |
| Catalog Number | AG01DWIR(AGN-PC-0ST4O0) |
| Chemical Name | 4-Fluoro-β-methylbenzeneethanol |
| IUPAC Name | 2-(4-fluorophenyl)propan-1-ol |
| InChI | InChI=1S/C9H11FO/c1-7(6-11)8-2-4-9(10)5-3-8/h2-5,7,11H,6H2,1H3 |
| InChI Key | DLIGEPKOWMTQQI-UHFFFAOYSA-N |
| MDL Number | MFCD16300884 |
| Molecular Formula | C9H11FO |
| Molecular Weight | 154.1814 |
| SMILES | CC(CO)C1=CC=C(C=C1)F |
| Synonyms | 2-(4-fluorophenyl)propan-1-ol,
59667-20-8,
(R)-2-(4-Fluorophenyl)propan-1-ol,
SCHEMBL2558297,
2-(4-fluorophenyl)propyl alcohol,
DLIGEPKOWMTQQI-UHFFFAOYSA-N,
AKOS014316420,
Benzeneethanol, 4-fluoro-beta-methyl-,
2-(4-fluoro-phenyl)-propan-1-ol,
(S)-2-(4-Fluorophenyl)propan-1-ol,
500019-44-3,
500019-47-6,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.184g/mol |
| Monoisotopic Mass | 154.079g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number