Home Sulfos 3-(Propane-1-sulfonamido)benzoic acid

3-(Propane-1-sulfonamido)benzoic acid

CAS No.:
849409-82-1
Catalog Number:
AG004VBN
Molecular Formula:
C10H13NO4S
Molecular Weight:
243.2795
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$69
- +
5g
98%
In Stock USA
United States
$225
- +
10g
98%
In Stock USA
United States
$350
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG004VBN
Chemical Name:
3-(Propane-1-sulfonamido)benzoic acid
CAS Number:
849409-82-1
Molecular Formula:
C10H13NO4S
Molecular Weight:
243.2795
MDL Number:
MFCD08444827
IUPAC Name:
3-(propylsulfonylamino)benzoic acid
InChI:
InChI=1S/C10H13NO4S/c1-2-6-16(14,15)11-9-5-3-4-8(7-9)10(12)13/h3-5,7,11H,2,6H2,1H3,(H,12,13)
InChI Key:
CTGSASQPVDRJOP-UHFFFAOYSA-N
SMILES:
CCCS(=O)(=O)Nc1cccc(c1)C(=O)O
Properties
Complexity:
333  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.057g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
243.277g/mol
Monoisotopic Mass:
243.057g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties