Home Other Building Blocks 2,3,4-trifluoro-5-sulfamoylbenzoic acid

2,3,4-trifluoro-5-sulfamoylbenzoic acid

CAS No.:
2090303-92-5
Catalog Number:
AG019YK7
Molecular Formula:
C7H4F3NO4S
Molecular Weight:
255.1712
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Product Description
Catalog Number:
AG019YK7
Chemical Name:
2,3,4-trifluoro-5-sulfamoylbenzoic acid
CAS Number:
2090303-92-5
Molecular Formula:
C7H4F3NO4S
Molecular Weight:
255.1712
MDL Number:
MFCD31381123
IUPAC Name:
2,3,4-trifluoro-5-sulfamoylbenzoic acid
InChI:
InChI=1S/C7H4F3NO4S/c8-4-2(7(12)13)1-3(16(11,14)15)5(9)6(4)10/h1H,(H,12,13)(H2,11,14,15)
InChI Key:
QQNGJNHKOKJXAH-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(c(c(c1F)F)F)S(=O)(=O)N
Properties
Complexity:
382  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.981g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.167g/mol
Monoisotopic Mass:
254.981g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties