Home Sulfos 4-(4-chlorobenzenesulfonyl)butanoic acid

4-(4-chlorobenzenesulfonyl)butanoic acid

CAS No.:
29193-68-8
Catalog Number:
AG01BACJ
Molecular Formula:
C10H11ClO4S
Molecular Weight:
262.7099
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Product Description
Catalog Number:
AG01BACJ
Chemical Name:
4-(4-chlorobenzenesulfonyl)butanoic acid
CAS Number:
29193-68-8
Molecular Formula:
C10H11ClO4S
Molecular Weight:
262.7099
MDL Number:
MFCD10024475
IUPAC Name:
4-(4-chlorophenyl)sulfonylbutanoic acid
InChI:
InChI=1S/C10H11ClO4S/c11-8-3-5-9(6-4-8)16(14,15)7-1-2-10(12)13/h3-6H,1-2,7H2,(H,12,13)
InChI Key:
JTTKCIMZPMUDCT-UHFFFAOYSA-N
SMILES:
OC(=O)CCCS(=O)(=O)c1ccc(cc1)Cl
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.007g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
262.704g/mol
Monoisotopic Mass:
262.007g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties