Home Sulfos 4-Benzenesulfonylamino-4-oxo-butyric acid

4-Benzenesulfonylamino-4-oxo-butyric acid

CAS No.:
100462-43-9
Catalog Number:
AG00021J
Molecular Formula:
C10H11NO5S
Molecular Weight:
257.2630
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$91
- +
1g
97%
1 week
United States
$212
- +
5g
97%
1 week
United States
$670
- +
Product Description
Catalog Number:
AG00021J
Chemical Name:
4-Benzenesulfonylamino-4-oxo-butyric acid
CAS Number:
100462-43-9
Molecular Formula:
C10H11NO5S
Molecular Weight:
257.2630
MDL Number:
MFCD01861218
IUPAC Name:
4-(benzenesulfonamido)-4-oxobutanoic acid
InChI:
InChI=1S/C10H11NO5S/c12-9(6-7-10(13)14)11-17(15,16)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)
InChI Key:
NVDKGZPVBHGXEZ-UHFFFAOYSA-N
SMILES:
O=C(NS(=O)(=O)c1ccccc1)CCC(=O)O
Properties
Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.036g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
257.26g/mol
Monoisotopic Mass:
257.036g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties