ruthenium(2+);triphenylphosphane;chloride

C18H15ClPRu+ — CID 56645241

IUPACruthenium(2+);triphenylphosphane;chloride
SMILES[Cl-].[Ru+2].c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15P.ClH.Ru/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;/h1-15H;1H;/q;;+2/p-1
InChIKeyZSNSPTRSMWAKDE-UHFFFAOYSA-M
MW398.82 g/mol
LogP0.45
Rot. Bonds3

About ruthenium(2+);triphenylphosphane;chloride

ruthenium(2+);triphenylphosphane;chloride (PubChem CID 56645241) has the molecular formula C18H15ClPRu+ and a molecular weight of 398.82 g/mol. Its IUPAC name is ruthenium(2+);triphenylphosphane;chloride.

Molecular Properties

Compound Nameruthenium(2+);triphenylphosphane;chloride
PubChem CID56645241
Molecular FormulaC18H15ClPRu+
Molecular Weight398.82 g/mol
Exact Mass398.96
IUPAC Nameruthenium(2+);triphenylphosphane;chloride
SMILES[Cl-].[Ru+2].c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C18H15P.ClH.Ru/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;/h1-15H;1H;/q;;+2/p-1
InChIKeyZSNSPTRSMWAKDE-UHFFFAOYSA-M
XLogP0.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.82
LogP ≤ 50.45
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

ruthenium(2+);tetrakis(triphenylphosphane);dichloride
CID 46940376
triphenylphosphane;yttrium
CID 139917776
rhodium(3+);nonakis(triphenylphosphane);trichloride
CID 173040367
phosphanium;tris(triphenylphosphane);chloride
CID 160938283
copper;triphenylphosphane;diiodide
CID 175718696
triphenylphosphane
CID 139056248
rhenium;bis(triphenylphosphane);trichloride;hydrate
CID 131675016
pentakis(palladium);hexadecakis(triphenylphosphane)
CID 173116735
iron dihydride;tetrakis(triphenylphosphane)
CID 172730134
tris(triphenylphosphane);hydrobromide
CID 172722268
tris(triphenylphosphane);trihydrochloride
CID 173282987
palladium;bis(triphenylphosphane)
CID 10122028

Frequently Asked Questions

What is the IUPAC name of ruthenium(2+);triphenylphosphane;chloride?
The IUPAC name of ruthenium(2+);triphenylphosphane;chloride (CID 56645241) is ruthenium(2+);triphenylphosphane;chloride.
What is the SMILES notation for ruthenium(2+);triphenylphosphane;chloride?
The canonical SMILES for ruthenium(2+);triphenylphosphane;chloride is [Cl-].[Ru+2].c1ccc(P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of ruthenium(2+);triphenylphosphane;chloride?
The InChIKey is ZSNSPTRSMWAKDE-UHFFFAOYSA-M. The full InChI is InChI=1S/C18H15P.ClH.Ru/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;/h1-15H;1H;/q;;+2/p-1.
What are the key properties of ruthenium(2+);triphenylphosphane;chloride?
ruthenium(2+);triphenylphosphane;chloride has a molecular weight of 398.82 g/mol, XLogP of 0.45, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ruthenium(2+);triphenylphosphane;chloride is sourced from PubChem (CID 56645241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).