| CAS Number | 1378670-41-7 |
| Catalog Number | AG01BS6O |
| Chemical Name | 3-Ethoxy-5-fluorobenzaldehyde |
| IUPAC Name | 3-ethoxy-5-fluorobenzaldehyde |
| InChI | InChI=1S/C9H9FO2/c1-2-12-9-4-7(6-11)3-8(10)5-9/h3-6H,2H2,1H3 |
| InChI Key | CWMKRMOJSUEPEG-UHFFFAOYSA-N |
| MDL Number | MFCD18375377 |
| Molecular Formula | C9H9FO2 |
| Molecular Weight | 168.1650 |
| SMILES | C(C)OC=1C=C(C=O)C=C(C1)F |
| Synonyms | 3-Ethoxy-5-fluorobenzaldehyde,
1378670-41-7,
ZINC95731787,
AKOS027392805,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.167g/mol |
| Monoisotopic Mass | 168.059g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number