diphenylphosphane;trichlororuthenium

C12H11Cl3PRu — CID 162065304

IUPACdiphenylphosphane;trichlororuthenium
SMILESCl[Ru](Cl)Cl.c1ccc(Pc2ccccc2)cc1
InChIInChI=1S/C12H11P.3ClH.Ru/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;;;/h1-10,13H;3*1H;/q;;;;+3/p-3
InChIKeyZAJNBMTWXQCWDX-UHFFFAOYSA-K
MW393.62 g/mol
LogP4.38
Rot. Bonds2

About diphenylphosphane;trichlororuthenium

diphenylphosphane;trichlororuthenium (PubChem CID 162065304) has the molecular formula C12H11Cl3PRu and a molecular weight of 393.62 g/mol. Its IUPAC name is diphenylphosphane;trichlororuthenium.

Molecular Properties

Compound Namediphenylphosphane;trichlororuthenium
PubChem CID162065304
Molecular FormulaC12H11Cl3PRu
Molecular Weight393.62 g/mol
Exact Mass392.87
IUPAC Namediphenylphosphane;trichlororuthenium
SMILESCl[Ru](Cl)Cl.c1ccc(Pc2ccccc2)cc1
InChIInChI=1S/C12H11P.3ClH.Ru/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;;;/h1-10,13H;3*1H;/q;;;;+3/p-3
InChIKeyZAJNBMTWXQCWDX-UHFFFAOYSA-K
XLogP4.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.62
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 160591319
bis(diphenylphosphane);zinc
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diphenylphosphane;iron(3+);methanone
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butane;dichloronickel;diphenylphosphane
CID 160852831
CID 66920881
CID 66920881
CID 23416022
CID 23416022

Frequently Asked Questions

What is the IUPAC name of diphenylphosphane;trichlororuthenium?
The IUPAC name of diphenylphosphane;trichlororuthenium (CID 162065304) is diphenylphosphane;trichlororuthenium.
What is the SMILES notation for diphenylphosphane;trichlororuthenium?
The canonical SMILES for diphenylphosphane;trichlororuthenium is Cl[Ru](Cl)Cl.c1ccc(Pc2ccccc2)cc1.
What is the InChIKey of diphenylphosphane;trichlororuthenium?
The InChIKey is ZAJNBMTWXQCWDX-UHFFFAOYSA-K. The full InChI is InChI=1S/C12H11P.3ClH.Ru/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;;;/h1-10,13H;3*1H;/q;;;;+3/p-3.
What are the key properties of diphenylphosphane;trichlororuthenium?
diphenylphosphane;trichlororuthenium has a molecular weight of 393.62 g/mol, XLogP of 4.38, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylphosphane;trichlororuthenium is sourced from PubChem (CID 162065304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).