Home Other Building Blocks 3-(cyclopropylsulfamoyl)-4-fluorobenzoic acid

3-(cyclopropylsulfamoyl)-4-fluorobenzoic acid

CAS No.:
926252-91-7
Catalog Number:
AG019LMT
Molecular Formula:
C10H10FNO4S
Molecular Weight:
259.2541
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Product Description
Catalog Number:
AG019LMT
Chemical Name:
3-(cyclopropylsulfamoyl)-4-fluorobenzoic acid
CAS Number:
926252-91-7
Molecular Formula:
C10H10FNO4S
Molecular Weight:
259.2541
MDL Number:
MFCD09041521
IUPAC Name:
3-(cyclopropylsulfamoyl)-4-fluorobenzoic acid
InChI:
InChI=1S/C10H10FNO4S/c11-8-4-1-6(10(13)14)5-9(8)17(15,16)12-7-2-3-7/h1,4-5,7,12H,2-3H2,(H,13,14)
InChI Key:
NHDVPJCXYONAJB-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)S(=O)(=O)NC1CC1)F
Properties
Complexity:
401  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.031g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
259.251g/mol
Monoisotopic Mass:
259.031g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties