Home Sulfos 2-trifluoromethanesulfonylbenzene-1-sulfonyl chloride

2-trifluoromethanesulfonylbenzene-1-sulfonyl chloride

CAS No.:
77797-87-6
Catalog Number:
AG01BH98
Molecular Formula:
C7H4ClF3O4S2
Molecular Weight:
308.6825
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Product Description
Catalog Number:
AG01BH98
Chemical Name:
2-trifluoromethanesulfonylbenzene-1-sulfonyl chloride
CAS Number:
77797-87-6
Molecular Formula:
C7H4ClF3O4S2
Molecular Weight:
308.6825
MDL Number:
MFCD16519539
IUPAC Name:
2-(trifluoromethylsulfonyl)benzenesulfonyl chloride
InChI:
InChI=1S/C7H4ClF3O4S2/c8-17(14,15)6-4-2-1-3-5(6)16(12,13)7(9,10)11/h1-4H
InChI Key:
OHTWWXFKNQKHNT-UHFFFAOYSA-N
SMILES:
O=S(=O)(C(F)(F)F)c1ccccc1S(=O)(=O)Cl
Properties
Complexity:
471  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.919g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.67g/mol
Monoisotopic Mass:
307.919g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties