| CAS Number | 1247613-99-5 |
| Catalog Number | AG01AIIG |
| Chemical Name | 2-(Difluoromethoxy)-4-methoxybenzaldehyde |
| IUPAC Name | 2-(difluoromethoxy)-4-methoxybenzaldehyde |
| InChI | InChI=1S/C9H8F2O3/c1-13-7-3-2-6(5-12)8(4-7)14-9(10)11/h2-5,9H,1H3 |
| InChI Key | MOOKIJWUMFKXMD-UHFFFAOYSA-N |
| MDL Number | MFCD14607629 |
| Molecular Formula | C9H8F2O3 |
| Molecular Weight | 202.1548 |
| SMILES | COC1=CC(OC(F)F)=C(C=O)C=C1 |
| Synonyms | 2-(difluoromethoxy)-4-methoxybenzaldehyde,
1247613-99-5,
ZINC40887824,
AKOS010520094,
NE15786,
EN300-77938,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.157g/mol |
| Monoisotopic Mass | 202.044g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number