| CAS Number | 73206-04-9 |
| Catalog Number | AG019MDW(AGN-PC-015QV2) |
| Chemical Name | 1-(4-Fluorophenyl)-4-hydroxybutan-1-one |
| IUPAC Name | 1-(4-fluorophenyl)-4-hydroxybutan-1-one |
| InChI | InChI=1S/C10H11FO2/c11-9-5-3-8(4-6-9)10(13)2-1-7-12/h3-6,12H,1-2,7H2 |
| InChI Key | ZCDDMISRNWSZPY-UHFFFAOYSA-N |
| MDL Number | MFCD08443119 |
| Molecular Formula | C10H11FO2 |
| Molecular Weight | 182.1915 |
| SMILES | FC1=CC=C(C=C1)C(CCCO)=O |
| Synonyms | 1-(4-fluorophenyl)-4-hydroxybutan-1-one,
73206-04-9,
AC1Q7CMX,
SCHEMBL11680631,
CTK8A3975,
gamma-Hydroxy-4'-fluorobutyrophenone,
MFCD08443119,
ZINC20282980,
AKOS000125998,
MCULE-9526662105,
1-(4-Fluorophenyl)-4-hydroxy-1-butanone,
EN300-35869,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.194g/mol |
| Monoisotopic Mass | 182.074g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number