Home Sulfos 1,3-Benzenedicarboxylic acid, 5-sulfo-, monosodium salt

1,3-Benzenedicarboxylic acid, 5-sulfo-, monosodium salt

CAS No.:
6362-79-4
Catalog Number:
AG00IB8T
Molecular Formula:
C8H6NaO7S
Molecular Weight:
269.1838
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$33
- +
25g
95%
In Stock USA
United States
$40
- +
100g
95%
In Stock USA
United States
$61
- +
500g
95%
In Stock USA
United States
$148
- +
Product Description
Catalog Number:
AG00IB8T
Chemical Name:
1,3-Benzenedicarboxylic acid, 5-sulfo-, monosodium salt
CAS Number:
6362-79-4
Molecular Formula:
C8H6NaO7S
Molecular Weight:
269.1838
MDL Number:
MFCD00007495
IUPAC Name:
sodium;3,5-dicarboxybenzenesulfonate
InChI:
InChI=1S/C8H6O7S.Na/c9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15;/h1-3H,(H,9,10)(H,11,12)(H,13,14,15);/q;+1/p-1
InChI Key:
YXTFRJVQOWZDPP-UHFFFAOYSA-M
SMILES:
OC(=O)c1cc(cc(c1)S(=O)(=O)O)C(=O)O.[Na]
EC Number:
228-845-2
UNII:
5I79J6MURZ
Properties
Complexity:
377  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.965g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
268.171g/mol
Monoisotopic Mass:
267.965g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
140A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties