| CAS Number | 103323-24-6 |
| Catalog Number | AG01DETH |
| Chemical Name | 1-(4-Ethylphenyl)-2-hydroxyethan-1-one |
| IUPAC Name | 1-(4-ethylphenyl)-2-hydroxyethanone |
| InChI | InChI=1S/C10H12O2/c1-2-8-3-5-9(6-4-8)10(12)7-11/h3-6,11H,2,7H2,1H3 |
| InChI Key | LDPGEBXSRJFAIX-UHFFFAOYSA-N |
| MDL Number | MFCD08443457 |
| Molecular Formula | C10H12O2 |
| Molecular Weight | 164.2011 |
| SMILES | CCC1=CC=C(C(CO)=O)C=C1 |
| Synonyms | 1-(4-ethylphenyl)-2-hydroxyethanone,
103323-24-6,
SCHEMBL8122311,
4'-Ethyl-2-hydroxyacetophenone,
ZINC40449663,
AKOS009115106,
1-(4-ethylphenyl)-2-hydroxyethan-1-one,
SY131012,
MFCD08443457 (95%),
4 inverted exclamation mark -Ethyl-2-hydroxyacetophenone,
1-(4-ethyl-phenyl)-2-hydroxy-ethanone,
|
| Complexity | 146 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.204g/mol |
| Monoisotopic Mass | 164.084g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number