[1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane

C24H24O2P2 — CID 20820418

IUPAC[1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane
SMILESCP(C)Oc1ccc2ccccc2c1-c1c(OP(C)C)ccc2ccccc12
InChIInChI=1S/C24H24O2P2/c1-27(2)25-21-15-13-17-9-5-7-11-19(17)23(21)24-20-12-8-6-10-18(20)14-16-22(24)26-28(3)4/h5-16H,1-4H3
InChIKeyDQSFSIVKDSAXOT-UHFFFAOYSA-N
MW406.40 g/mol
LogP7.73
Rot. Bonds5

About [1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane

[1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane (PubChem CID 20820418) has the molecular formula C24H24O2P2 and a molecular weight of 406.40 g/mol. Its IUPAC name is [1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane.

Molecular Properties

Compound Name[1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane
PubChem CID20820418
Molecular FormulaC24H24O2P2
Molecular Weight406.40 g/mol
Exact Mass406.13
IUPAC Name[1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane
SMILESCP(C)Oc1ccc2ccccc2c1-c1c(OP(C)C)ccc2ccccc12
InChIInChI=1S/C24H24O2P2/c1-27(2)25-21-15-13-17-9-5-7-11-19(17)23(21)24-20-12-8-6-10-18(20)14-16-22(24)26-28(3)4/h5-16H,1-4H3
InChIKeyDQSFSIVKDSAXOT-UHFFFAOYSA-N
XLogP7.73
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.40
LogP ≤ 57.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane?
The IUPAC name of [1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane (CID 20820418) is [1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane.
What is the SMILES notation for [1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane?
The canonical SMILES for [1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane is CP(C)Oc1ccc2ccccc2c1-c1c(OP(C)C)ccc2ccccc12.
What is the InChIKey of [1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane?
The InChIKey is DQSFSIVKDSAXOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24O2P2/c1-27(2)25-21-15-13-17-9-5-7-11-19(17)23(21)24-20-12-8-6-10-18(20)14-16-22(24)26-28(3)4/h5-16H,1-4H3.
What are the key properties of [1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane?
[1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane has a molecular weight of 406.40 g/mol, XLogP of 7.73, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-dimethylphosphanyloxynaphthalen-1-yl)naphthalen-2-yl]oxy-dimethylphosphane is sourced from PubChem (CID 20820418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).