Home Sulfos 4-(propane-1-sulfonyl)benzene-1-sulfonyl chloride

4-(propane-1-sulfonyl)benzene-1-sulfonyl chloride

CAS No.:
1250742-44-9
Catalog Number:
AG01BBO2
Molecular Formula:
C9H11ClO4S2
Molecular Weight:
282.7642
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Product Description
Catalog Number:
AG01BBO2
Chemical Name:
4-(propane-1-sulfonyl)benzene-1-sulfonyl chloride
CAS Number:
1250742-44-9
Molecular Formula:
C9H11ClO4S2
Molecular Weight:
282.7642
MDL Number:
MFCD16093684
IUPAC Name:
4-propylsulfonylbenzenesulfonyl chloride
InChI:
InChI=1S/C9H11ClO4S2/c1-2-7-15(11,12)8-3-5-9(6-4-8)16(10,13)14/h3-6H,2,7H2,1H3
InChI Key:
ZWHGSOACWLFGCI-UHFFFAOYSA-N
SMILES:
CCCS(=O)(=O)c1ccc(cc1)S(=O)(=O)Cl
Properties
Complexity:
407  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.979g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.753g/mol
Monoisotopic Mass:
281.979g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties