| CAS Number | 1343664-57-2 |
| Catalog Number | AG01B1HZ |
| Chemical Name | 1-(3-Chloro-2-fluorophenyl)propan-1-ol |
| IUPAC Name | 1-(3-chloro-2-fluorophenyl)propan-1-ol |
| InChI | InChI=1S/C9H10ClFO/c1-2-8(12)6-4-3-5-7(10)9(6)11/h3-5,8,12H,2H2,1H3 |
| InChI Key | HMHURBVMAYTKBB-UHFFFAOYSA-N |
| MDL Number | MFCD20400977 |
| Molecular Formula | C9H10ClFO |
| Molecular Weight | 188.6265 |
| SMILES | CCC(C1=C(F)C(Cl)=CC=C1)O |
| Synonyms | 1-(3-chloro-2-fluorophenyl)propan-1-ol,
1343664-57-2,
SCHEMBL15915397,
AKOS014040288,
MCULE-6404657929,
NE44329,
Z1801361773,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.626g/mol |
| Monoisotopic Mass | 188.04g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number