Home Sulfos Benzenesulfonic acid, 4,4'-(phenylphosphinidene)bis-, potassium salt, hydrate (1:2:2)

Benzenesulfonic acid, 4,4'-(phenylphosphinidene)bis-, potassium salt, hydrate (1:2:2)

CAS No.:
308103-66-4
Catalog Number:
AG0031D2
Molecular Formula:
C18H17K2O8PS2
Molecular Weight:
534.6231
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Product Description
Catalog Number:
AG0031D2
Chemical Name:
Benzenesulfonic acid, 4,4'-(phenylphosphinidene)bis-, potassium salt, hydrate (1:2:2)
CAS Number:
308103-66-4
Molecular Formula:
C18H17K2O8PS2
Molecular Weight:
534.6231
MDL Number:
MFCD22123379
IUPAC Name:
dipotassium;4-[phenyl-(4-sulfonatophenyl)phosphanyl]benzenesulfonate;hydrate
InChI:
InChI=1S/C18H15O6PS2.2K.H2O/c19-26(20,21)17-10-6-15(7-11-17)25(14-4-2-1-3-5-14)16-8-12-18(13-9-16)27(22,23)24;;;/h1-13H,(H,19,20,21)(H,22,23,24);;;1H2/q;2*+1;/p-2
InChI Key:
PRAGZPSLQQRHKD-UHFFFAOYSA-L
SMILES:
[O-]S(=O)(=O)c1ccc(cc1)P(c1ccc(cc1)S(=O)(=O)[O-])c1ccccc1.O.O.[K+].[K+]
Properties
Complexity:
596  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
515.927g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
516.601g/mol
Monoisotopic Mass:
515.927g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties