Home Sulfos 3-benzoylbenzene-1-sulfonyl chloride

3-benzoylbenzene-1-sulfonyl chloride

CAS No.:
53558-61-5
Catalog Number:
AG01B968
Molecular Formula:
C13H9ClO3S
Molecular Weight:
280.7268
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Product Description
Catalog Number:
AG01B968
Chemical Name:
3-benzoylbenzene-1-sulfonyl chloride
CAS Number:
53558-61-5
Molecular Formula:
C13H9ClO3S
Molecular Weight:
280.7268
MDL Number:
MFCD10693749
IUPAC Name:
3-benzoylbenzenesulfonyl chloride
InChI:
InChI=1S/C13H9ClO3S/c14-18(16,17)12-8-4-7-11(9-12)13(15)10-5-2-1-3-6-10/h1-9H
InChI Key:
HUQKJUIDRNDNQY-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)S(=O)(=O)Cl)c1ccccc1
Properties
Complexity:
393  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.996g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.722g/mol
Monoisotopic Mass:
279.996g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties