| CAS Number | 845866-83-3 |
| Catalog Number | AG00G5LJ(AGN-PC-0WBRP0) |
| Chemical Name | 2-Chloro-1-(difluoromethyl)-4-fluorobenzene |
| IUPAC Name | 2-chloro-1-(difluoromethyl)-4-fluorobenzene |
| InChI | InChI=1S/C7H4ClF3/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3,7H |
| InChI Key | PFBUYSAQGBJZMH-UHFFFAOYSA-N |
| MDL Number | MFCD06657966 |
| Molecular Formula | C7H4ClF3 |
| Molecular Weight | 180.5549 |
| SMILES | c1c(cc(c(c1)C(F)F)Cl)F |
| Synonyms | 2-chloro-1-(difluoromethyl)-4-fluorobenzene,
845866-83-3,
2-Chloro-1-difluoromethyl-4-fluorobenzene,
AC1MC4DE,
CTK7B8744,
DTXSID10375610,
0484AF,
ZINC63926204,
AKOS005256033,
FS-4718,
RTR-057672,
TR-057672,
C7H4ClF3,
CID2761184,
2-chloro-1-(difluoromethyl)-4-fluoro-benzene,
|
| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.554g/mol |
| Monoisotopic Mass | 179.995g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number