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Structure

Diphenylsulfone-3,3'-disulfonic acid disodium salt

CAS
39616-93-8
Catalog Number
ACM39616938
Category
Other Products
Molecular Weight
422.4g/mol
Molecular Formula
C12H8Na2O8S3

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Specification

IUPAC Name
disodium;3-(3-sulfonatophenyl)sulfonylbenzenesulfonate
Canonical SMILES
C1=CC(=CC(=C1)S(=O)(=O)[O-])S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)[O-].[Na+].[Na+]
InChI
InChI=1S/C12H10O8S3.2Na/c13-21(14,9-3-1-5-11(7-9)22(15,16)17)10-4-2-6-12(8-10)23(18,19)20;;/h1-8H,(H,15,16,17)(H,18,19,20);;/q;2*+1/p-2
InChI Key
GOPLREGDBGPRSC-UHFFFAOYSA-L
Complexity
636
Covalently-Bonded Unit Count
3
Exact Mass
421.917669g/mol
Formal Charge
0
H-Bond Acceptor
8
H-Bond Donor
0
Heavy Atom Count
25
Monoisotopic Mass
421.917669g/mol
Rotatable Bond Count
2
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