| CAS Number | 1262409-43-7 |
| Catalog Number | AG000SE3(AGN-PC-0AM1D4) |
| Chemical Name | Cyclohexanesulfonyl chloride, 4-oxo- |
| IUPAC Name | 4-oxocyclohexane-1-sulfonyl chloride |
| InChI | InChI=1S/C6H9ClO3S/c7-11(9,10)6-3-1-5(8)2-4-6/h6H,1-4H2 |
| InChI Key | IJOOLKIYFVIJNU-UHFFFAOYSA-N |
| MDL Number | MFCD18375222 |
| Molecular Formula | C6H9ClO3S |
| Molecular Weight | 196.6519 |
| SMILES | O=C1CCC(CC1)S(=O)(=O)Cl |
| Synonyms | 1262409-43-7,
4-oxocyclohexane-1-sulfonyl chloride,
4-Oxo-cyclohexanesulfonyl chloride,
4-(Chlorosulfonyl)cyclohexanone,
PubChem24198,
C6H9ClO3S,
SCHEMBL16052074,
DTXSID00717343,
IJOOLKIYFVIJNU-UHFFFAOYSA-N,
2910AJ,
Cyclohexanesulfonyl chloride, 4-oxo-,
AKOS006335787,
ZINC100253583,
ACN-045082,
SY059132,
MFCD18375222 (95%),
Z-6869,
|
| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.996g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.645g/mol |
| Monoisotopic Mass | 195.996g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 59.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
8
|
|
Hazard statements
|
H314
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P280-P305+P351+P338-P310
|
|
UN Code
|
UN 3261
|
Certificate of Analysis
Lot Number