Home Halogens 2-(4-chloro-3-sulphamoylbenzoyl)benzoic acid

2-(4-chloro-3-sulphamoylbenzoyl)benzoic acid

CAS No.:
5270-74-6
Catalog Number:
AG00DF1E
Molecular Formula:
C14H10ClNO5S
Molecular Weight:
339.7509
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Product Description
Catalog Number:
AG00DF1E
Chemical Name:
2-(4-chloro-3-sulphamoylbenzoyl)benzoic acid
CAS Number:
5270-74-6
Molecular Formula:
C14H10ClNO5S
Molecular Weight:
339.7509
MDL Number:
MFCD09753828
IUPAC Name:
2-(4-chloro-3-sulfamoylbenzoyl)benzoic acid
InChI:
InChI=1S/C14H10ClNO5S/c15-11-6-5-8(7-12(11)22(16,20)21)13(17)9-3-1-2-4-10(9)14(18)19/h1-7H,(H,18,19)(H2,16,20,21)
InChI Key:
UKRADWWBRBBJLZ-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1C(=O)O)c1ccc(c(c1)S(=O)(=O)N)Cl
EC Number:
226-089-8
Properties
Complexity:
544  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.997g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
339.746g/mol
Monoisotopic Mass:
338.997g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties