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Home Sulfos 4-Formylbenzenesulfonic acid

4-Formylbenzenesulfonic acid

CAS No.:
5363-54-2
Catalog Number:
AG00DF4M
Molecular Formula:
C7H6O4S
Molecular Weight:
186.1851
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$389
- +
1g
95%
1 week
United States
$914
- +
Product Description
Catalog Number:
AG00DF4M
Chemical Name:
4-Formylbenzenesulfonic acid
CAS Number:
5363-54-2
Molecular Formula:
C7H6O4S
Molecular Weight:
186.1851
MDL Number:
MFCD22570289
IUPAC Name:
4-formylbenzenesulfonic acid
InChI:
InChI=1S/C7H6O4S/c8-5-6-1-3-7(4-2-6)12(9,10)11/h1-5H,(H,9,10,11)
InChI Key:
XSAOGXMGZVFIIE-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)S(=O)(=O)O
EC Number:
226-349-0
UNII:
9I21R96066
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.999g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.181g/mol
Monoisotopic Mass:
185.999g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
Degradation of a stilbene-type fluorescent whitening agent with hypochlorite: identification of the degradation products by capillary electrophoresis. Environmental toxicology and chemistry 20011001
The T cell regulator gene SH2D2A contributes to the genetic susceptibility of multiple sclerosis. Genes and immunity 20010801
Properties