| CAS Number | 145742-68-3 |
| Catalog Number | AG019MGY(AGN-PC-0LH1A9) |
| Chemical Name | 5-Chloro-2-(difluoromethoxy)benzaldehyde |
| IUPAC Name | 5-chloro-2-(difluoromethoxy)benzaldehyde |
| InChI | InChI=1S/C8H5ClF2O2/c9-6-1-2-7(13-8(10)11)5(3-6)4-12/h1-4,8H |
| InChI Key | FRNLODWJIKMPDY-UHFFFAOYSA-N |
| MDL Number | MFCD03412195 |
| Molecular Formula | C8H5ClF2O2 |
| Molecular Weight | 206.5739 |
| SMILES | O=CC1=CC(Cl)=CC=C1OC(F)F |
| Synonyms | 5-chloro-2-(difluoromethoxy)benzaldehyde,
145742-68-3,
AC1NHTV4,
AC1Q4KOF,
SCHEMBL613846,
CTK7H8848,
FRNLODWJIKMPDY-UHFFFAOYSA-N,
ZINC2529873,
MFCD03412195,
SBB093745,
AKOS000297141,
NE23713,
PS-8069,
2-(difluoromethoxy)-5-chlorobenzaldehyde,
5-chloro-2-(difluoromethoxy) benzaldehyde,
Benzaldehyde, 5-chloro-2-(difluoromethoxy)-,
EN300-36149,
CID4770949,
|
| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.573g/mol |
| Monoisotopic Mass | 205.995g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number