diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+)

C32H24PRu — CID 150075579

IUPACdiphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+)
SMILES[Ru+].[c-]1ccc2ccccc2c1-c1cccc2ccccc12.c1ccc(Pc2ccccc2)cc1
InChIInChI=1S/C20H13.C12H11P.Ru/c1-3-11-17-15(7-1)9-5-13-19(17)20-14-6-10-16-8-2-4-12-18(16)20;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-13H;1-10,13H;/q-1;;+1
InChIKeyXDYDVQGMSYWRKI-UHFFFAOYSA-N
MW540.59 g/mol
LogP7.77
Rot. Bonds3

About diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+)

diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+) (PubChem CID 150075579) has the molecular formula C32H24PRu and a molecular weight of 540.59 g/mol. Its IUPAC name is diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+).

Molecular Properties

Compound Namediphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+)
PubChem CID150075579
Molecular FormulaC32H24PRu
Molecular Weight540.59 g/mol
Exact Mass541.07
IUPAC Namediphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+)
SMILES[Ru+].[c-]1ccc2ccccc2c1-c1cccc2ccccc12.c1ccc(Pc2ccccc2)cc1
InChIInChI=1S/C20H13.C12H11P.Ru/c1-3-11-17-15(7-1)9-5-13-19(17)20-14-6-10-16-8-2-4-12-18(16)20;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-13H;1-10,13H;/q-1;;+1
InChIKeyXDYDVQGMSYWRKI-UHFFFAOYSA-N
XLogP7.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500540.59
LogP ≤ 57.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 69376174
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tetrakis(1-naphthalen-1-ylnaphthalene);tetrahydrochloride
CID 173126408
CID 175282704
CID 175282704
bis(1-naphthalen-1-ylnaphthalene);phosphane
CID 175426418
1-naphthalen-1-ylnaphthalene;tetrahydrochloride
CID 68981096
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CID 59169251
1-naphthalen-1-ylnaphthalene;phenol
CID 174330284
bis(2-(2-naphthalen-1-ylbenzene-6-id-1-yl)pyridine);platinum(2+)
CID 58939493
2-(2H-naphthalen-2-id-1-yl)-3H-furan-3-ide;yttrium
CID 58813865
magnesium;1-phenylnaphthalene;bromide
CID 58193913
1-naphthalen-1-ylnaphthalene;ruthenium(2+);dichloride
CID 11327769

Frequently Asked Questions

What is the IUPAC name of diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+)?
The IUPAC name of diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+) (CID 150075579) is diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+).
What is the SMILES notation for diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+)?
The canonical SMILES for diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+) is [Ru+].[c-]1ccc2ccccc2c1-c1cccc2ccccc12.c1ccc(Pc2ccccc2)cc1.
What is the InChIKey of diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+)?
The InChIKey is XDYDVQGMSYWRKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13.C12H11P.Ru/c1-3-11-17-15(7-1)9-5-13-19(17)20-14-6-10-16-8-2-4-12-18(16)20;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-13H;1-10,13H;/q-1;;+1.
What are the key properties of diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+)?
diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+) has a molecular weight of 540.59 g/mol, XLogP of 7.77, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylphosphane;1-naphthalen-1-yl-2H-naphthalen-2-ide;ruthenium(1+) is sourced from PubChem (CID 150075579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).