Home Sulfos 3-(2-fluorobenzenesulfonamido)propanoic acid

3-(2-fluorobenzenesulfonamido)propanoic acid

CAS No.:
613657-21-9
Catalog Number:
AG019HMT
Molecular Formula:
C9H10FNO4S
Molecular Weight:
247.2434
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Product Description
Catalog Number:
AG019HMT
Chemical Name:
3-(2-fluorobenzenesulfonamido)propanoic acid
CAS Number:
613657-21-9
Molecular Formula:
C9H10FNO4S
Molecular Weight:
247.2434
MDL Number:
MFCD03620133
IUPAC Name:
3-[(2-fluorophenyl)sulfonylamino]propanoic acid
InChI:
InChI=1S/C9H10FNO4S/c10-7-3-1-2-4-8(7)16(14,15)11-6-5-9(12)13/h1-4,11H,5-6H2,(H,12,13)
InChI Key:
IHHDUPWVGVAAMD-UHFFFAOYSA-N
SMILES:
OC(=O)CCNS(=O)(=O)c1ccccc1F
Properties
Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.031g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
247.24g/mol
Monoisotopic Mass:
247.031g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties