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121208-93-3 | 4-Hydroxy-3-iodobenzenesufonic Acid, Sodium Salt
CAS No: 121208-93-3 Catalog No: AG007P4D MDL No:
Product Description
Catalog Number:
AG007P4D
Chemical Name:
4-Hydroxy-3-iodobenzenesufonic Acid, Sodium Salt
CAS Number:
121208-93-3
Molecular Formula:
C6H4INaO4S
Molecular Weight:
322.0528
IUPAC Name:
sodium;4-hydroxy-3-iodobenzenesulfonate
InChI:
InChI=1S/C6H5IO4S.Na/c7-5-3-4(12(9,10)11)1-2-6(5)8;/h1-3,8H,(H,9,10,11);/q;+1/p-1
InChI Key:
SCLIUSOXAHUMQN-UHFFFAOYSA-M
SMILES:
[Na]OS(=O)(=O)c1ccc(c(c1)I)O
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.877g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
322.048g/mol
Monoisotopic Mass:
321.877g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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