| CAS Number | 1378655-94-7 |
| Catalog Number | AG01BXM3 |
| Chemical Name | 2-Fluoro-5-methoxy-4-methylbenzaldehyde |
| IUPAC Name | 2-fluoro-5-methoxy-4-methylbenzaldehyde |
| InChI | InChI=1S/C9H9FO2/c1-6-3-8(10)7(5-11)4-9(6)12-2/h3-5H,1-2H3 |
| InChI Key | PTVFMGRDQFDCMJ-UHFFFAOYSA-N |
| MDL Number | MFCD19440289 |
| Molecular Formula | C9H9FO2 |
| Molecular Weight | 168.165 |
| SMILES | COC1=C(C)C=C(F)C(C=O)=C1 |
| Synonyms | 2-fluoro-5-methoxy-4-methylbenzaldehyde,
1378655-94-7,
SCHEMBL15033540,
ZINC213921127,
|
| Complexity | 161 |
| 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 | 2 |
| 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
Certificate of Analysis
Lot Number