| CAS Number | 1208075-41-5 |
| Catalog Number | AG003KYT(AGN-PC-08XZ6P) |
| Chemical Name | 4-Bromo-5-chloro-2-fluorobenzene-1-sulfonyl chloride |
| IUPAC Name | 4-bromo-5-chloro-2-fluorobenzenesulfonyl chloride |
| InChI | InChI=1S/C6H2BrCl2FO2S/c7-3-1-5(10)6(2-4(3)8)13(9,11)12/h1-2H |
| InChI Key | VNPRKBFETGIANP-UHFFFAOYSA-N |
| MDL Number | MFCD12026216 |
| Molecular Formula | C6H2BrCl2FO2S |
| Molecular Weight | 307.9523 |
| SMILES | O=S(C1=CC(Cl)=C(Br)C=C1F)(Cl)=O |
| Synonyms | 1208075-41-5,
4-Bromo-5-chloro-2-fluorobenzene-1-sulfonyl chloride,
4-Bromo-5-chloro-2-fluorobenzenesulfonyl chloride,
C6H2BrCl2FO2S,
SCHEMBL16759572,
KS-00000ERZ,
VNPRKBFETGIANP-UHFFFAOYSA-N,
6120AJ,
MFCD12026216,
AKOS024259012,
ZINC100031068,
CS-W022106,
DS-9393,
NE15375,
AK158819,
SY029135,
ST2405637,
FT-0728466,
MFCD12026216 (95%),
4-Bromo-5-chloro-2-fluorobenzenesulfonylChloride,
4-BROMO-5-CHLORO-2-FLUOROBENZENE-1-SULFONYLCHLORIDE,
|
| Complexity | 279 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 305.832g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 307.942g/mol |
| Monoisotopic Mass | 305.832g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
8
|
|
Hazard statements
|
H317-H319
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P280-P305+P351+P338
|
|
UN Code
|
UN 3261
|
Certificate of Analysis
Lot Number