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Tris(3-sulfonatophenyl) phosphine

HCID 3675707
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=S(=O)([O-])c1cccc(P(c2cccc(S(=O)(=O)[O-])c2)c2cccc(S(=O)(=O)[O-])c2)c1
InChIKey
ZBMZOFSLQIPSPW-UHFFFAOYSA-K
Molecular formula
C18H12O9PS3-3
Average molar mass
499.5 g/mol
Monoisotopic mass
498.93810747

Names & identifiers

Preferred name
Tris(3-sulfonatophenyl) phosphine
IUPAC
3-bis(3-sulfonatophenyl)phosphanylbenzenesulfonate

Names & synonyms

tris(3-sulfonatophenyl) phosphineZBMZOFSLQIPSPW-UHFFFAOYSA-K3,3',3''-phosphinetriyltribenzenesulfonate

Database identifiers

PubChem CID
3675707
Nikkaji
J1.284.724F

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
197 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
9
Rotatable bonds
3
Heavy atoms
31
Formal charge
-3
Complexity
768

Related reactions

4 records
New reaction record
HRID 209910 reaction equation
HRID 209910As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 516559 reaction equation
HRID 516559As reactantuspto-grants-2015_08
HRID 688199 reaction equation
HRID 688199As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 2162359 reaction equation
HRID 2162359As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes