ruthenium;(2,3,4-triphenylphenyl)phosphane

C24H19PRu — CID 161293596

IUPACruthenium;(2,3,4-triphenylphenyl)phosphane
SMILESPc1ccc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.[Ru]
InChIInChI=1S/C24H19P.Ru/c25-22-17-16-21(18-10-4-1-5-11-18)23(19-12-6-2-7-13-19)24(22)20-14-8-3-9-15-20;/h1-17H,25H2;
InChIKeyVGRKFYGVDJWZMX-UHFFFAOYSA-N
MW439.46 g/mol
LogP6.19
Rot. Bonds3

About ruthenium;(2,3,4-triphenylphenyl)phosphane

ruthenium;(2,3,4-triphenylphenyl)phosphane (PubChem CID 161293596) has the molecular formula C24H19PRu and a molecular weight of 439.46 g/mol. Its IUPAC name is ruthenium;(2,3,4-triphenylphenyl)phosphane.

Molecular Properties

Compound Nameruthenium;(2,3,4-triphenylphenyl)phosphane
PubChem CID161293596
Molecular FormulaC24H19PRu
Molecular Weight439.46 g/mol
Exact Mass440.03
IUPAC Nameruthenium;(2,3,4-triphenylphenyl)phosphane
SMILESPc1ccc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.[Ru]
InChIInChI=1S/C24H19P.Ru/c25-22-17-16-21(18-10-4-1-5-11-18)23(19-12-6-2-7-13-19)24(22)20-14-8-3-9-15-20;/h1-17H,25H2;
InChIKeyVGRKFYGVDJWZMX-UHFFFAOYSA-N
XLogP6.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500439.46
LogP ≤ 56.19
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 ruthenium;(2,3,4-triphenylphenyl)phosphane?
The IUPAC name of ruthenium;(2,3,4-triphenylphenyl)phosphane (CID 161293596) is ruthenium;(2,3,4-triphenylphenyl)phosphane.
What is the SMILES notation for ruthenium;(2,3,4-triphenylphenyl)phosphane?
The canonical SMILES for ruthenium;(2,3,4-triphenylphenyl)phosphane is Pc1ccc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.[Ru].
What is the InChIKey of ruthenium;(2,3,4-triphenylphenyl)phosphane?
The InChIKey is VGRKFYGVDJWZMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19P.Ru/c25-22-17-16-21(18-10-4-1-5-11-18)23(19-12-6-2-7-13-19)24(22)20-14-8-3-9-15-20;/h1-17H,25H2;.
What are the key properties of ruthenium;(2,3,4-triphenylphenyl)phosphane?
ruthenium;(2,3,4-triphenylphenyl)phosphane has a molecular weight of 439.46 g/mol, XLogP of 6.19, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ruthenium;(2,3,4-triphenylphenyl)phosphane is sourced from PubChem (CID 161293596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).