| CAS Number | 1196154-77-4 |
| Catalog Number | AG000PC2(AGN-PC-0WD0KZ) |
| Chemical Name | 4,4-Difluorocyclohexane-1-sulfonyl chloride |
| IUPAC Name | 4,4-difluorocyclohexane-1-sulfonyl chloride |
| InChI | InChI=1S/C6H9ClF2O2S/c7-12(10,11)5-1-3-6(8,9)4-2-5/h5H,1-4H2 |
| InChI Key | NABYUBSREFQSDU-UHFFFAOYSA-N |
| MDL Number | MFCD10000567 |
| Molecular Formula | C6H9ClF2O2S |
| Molecular Weight | 218.6493 |
| SMILES | FC1(CCC(S(Cl)(=O)=O)CC1)F |
| Synonyms | 4,4-Difluorocyclohexane-1-sulfonyl chloride,
1196154-77-4,
C6H9ClF2O2S,
SCHEMBL1093575,
DTXSID10697364,
3382AA,
AKOS006240736,
ZINC100069209,
AB55855,
Cyclohexanesulfonyl chloride, 4,4-difluoro-,
4,4-DIFLUORO-CYCLOHEXANESULFONYL CHLORIDE,
|
| Complexity | 247 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.998g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.643g/mol |
| Monoisotopic Mass | 217.998g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number