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Home Sulfos Benzoic acid,2-chloro-5-[[(1-methylethyl)amino]sulfonyl]-

Benzoic acid,2-chloro-5-[[(1-methylethyl)amino]sulfonyl]-

CAS No.:
74138-28-6
Catalog Number:
AG005ZO3
Molecular Formula:
C10H12ClNO4S
Molecular Weight:
277.7246
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Product Description
Catalog Number:
AG005ZO3
Chemical Name:
Benzoic acid,2-chloro-5-[[(1-methylethyl)amino]sulfonyl]-
CAS Number:
74138-28-6
Molecular Formula:
C10H12ClNO4S
Molecular Weight:
277.7246
MDL Number:
MFCD05988614
IUPAC Name:
2-chloro-5-(propan-2-ylsulfamoyl)benzoic acid
InChI:
InChI=1S/C10H12ClNO4S/c1-6(2)12-17(15,16)7-3-4-9(11)8(5-7)10(13)14/h3-6,12H,1-2H3,(H,13,14)
InChI Key:
SEYHVXLJZBTBCF-UHFFFAOYSA-N
SMILES:
CC(NS(=O)(=O)c1ccc(c(c1)C(=O)O)Cl)C
Properties
Complexity:
376  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.018g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
277.719g/mol
Monoisotopic Mass:
277.018g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties