| CAS Number | 2721-15-5 |
| Catalog Number | AG01A2ST(AGN-PC-0R31UC) |
| Chemical Name | 2-(4-fluorophenyl)propanal |
| IUPAC Name | 2-(4-fluorophenyl)propanal |
| InChI | InChI=1S/C9H9FO/c1-7(6-11)8-2-4-9(10)5-3-8/h2-7H,1H3 |
| InChI Key | AANCPBXTNIZNIJ-UHFFFAOYSA-N |
| MDL Number | MFCD11934375 |
| Molecular Formula | C9H9FO |
| Molecular Weight | 152.1656 |
| SMILES | CC(C1=CC=C(F)C=C1)C=O |
| Synonyms | 2-(4-fluorophenyl)propanal,
189445-63-4,
2721-15-5,
SCHEMBL7916328,
CTK4E0136,
DTXSID30457861,
2-(4-fluoro-phenyl)-propionaldehyde,
AKOS014312354,
NE26784,
Benzeneacetaldehyde,4-fluoro-a-methyl-, (-)-,
F1967-2635,
279683-49-7,
CID11182703,
|
| Complexity | 128 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.168g/mol |
| Monoisotopic Mass | 152.064g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number