tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate

C32H52O2P4Pt2+4 — CID 6395688

IUPACtetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate
SMILESC[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.O.O.[Pt].[Pt]
InChIInChI=1S/4C8H11P.2H2O.2Pt/c4*1-9(2)8-6-4-3-5-7-8;;;;/h4*3-7H,1-2H3;2*1H2;;/p+4
InChIKeyGQVJRIQZARMBEG-UHFFFAOYSA-R
MW982.82 g/mol
LogP5.49
Rot. Bonds4

About tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate

tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate (PubChem CID 6395688) has the molecular formula C32H52O2P4Pt2+4 and a molecular weight of 982.82 g/mol. Its IUPAC name is tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate.

Molecular Properties

Compound Nametetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate
PubChem CID6395688
Molecular FormulaC32H52O2P4Pt2+4
Molecular Weight982.82 g/mol
Exact Mass982.22
IUPAC Nametetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate
SMILESC[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.O.O.[Pt].[Pt]
InChIInChI=1S/4C8H11P.2H2O.2Pt/c4*1-9(2)8-6-4-3-5-7-8;;;;/h4*3-7H,1-2H3;2*1H2;;/p+4
InChIKeyGQVJRIQZARMBEG-UHFFFAOYSA-R
XLogP5.49
TPSA63.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500982.82
LogP ≤ 55.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate?
The IUPAC name of tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate (CID 6395688) is tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate.
What is the SMILES notation for tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate?
The canonical SMILES for tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate is C[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.C[PH+](C)c1ccccc1.O.O.[Pt].[Pt].
What is the InChIKey of tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate?
The InChIKey is GQVJRIQZARMBEG-UHFFFAOYSA-R. The full InChI is InChI=1S/4C8H11P.2H2O.2Pt/c4*1-9(2)8-6-4-3-5-7-8;;;;/h4*3-7H,1-2H3;2*1H2;;/p+4.
What are the key properties of tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate?
tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate has a molecular weight of 982.82 g/mol, XLogP of 5.49, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(dimethyl(phenyl)phosphanium);platinum;dihydrate is sourced from PubChem (CID 6395688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).