2-diphenylphosphoryl-1-methylnaphthalene

C23H19OP — CID 150613039

IUPAC2-diphenylphosphoryl-1-methylnaphthalene
SMILESCc1c(P(=O)(c2ccccc2)c2ccccc2)ccc2ccccc12
InChIInChI=1S/C23H19OP/c1-18-22-15-9-8-10-19(22)16-17-23(18)25(24,20-11-4-2-5-12-20)21-13-6-3-7-14-21/h2-17H,1H3
InChIKeyIUHWOHNSXYWWNO-UHFFFAOYSA-N
MW342.38 g/mol
LogP4.79
Rot. Bonds3

About 2-diphenylphosphoryl-1-methylnaphthalene

2-diphenylphosphoryl-1-methylnaphthalene (PubChem CID 150613039) has the molecular formula C23H19OP and a molecular weight of 342.38 g/mol. Its IUPAC name is 2-diphenylphosphoryl-1-methylnaphthalene.

Molecular Properties

Compound Name2-diphenylphosphoryl-1-methylnaphthalene
PubChem CID150613039
Molecular FormulaC23H19OP
Molecular Weight342.38 g/mol
Exact Mass342.12
IUPAC Name2-diphenylphosphoryl-1-methylnaphthalene
SMILESCc1c(P(=O)(c2ccccc2)c2ccccc2)ccc2ccccc12
InChIInChI=1S/C23H19OP/c1-18-22-15-9-8-10-19(22)16-17-23(18)25(24,20-11-4-2-5-12-20)21-13-6-3-7-14-21/h2-17H,1H3
InChIKeyIUHWOHNSXYWWNO-UHFFFAOYSA-N
XLogP4.79
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.38
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-diphenylphosphoryl-1-methylnaphthalene?
The IUPAC name of 2-diphenylphosphoryl-1-methylnaphthalene (CID 150613039) is 2-diphenylphosphoryl-1-methylnaphthalene.
What is the SMILES notation for 2-diphenylphosphoryl-1-methylnaphthalene?
The canonical SMILES for 2-diphenylphosphoryl-1-methylnaphthalene is Cc1c(P(=O)(c2ccccc2)c2ccccc2)ccc2ccccc12.
What is the InChIKey of 2-diphenylphosphoryl-1-methylnaphthalene?
The InChIKey is IUHWOHNSXYWWNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19OP/c1-18-22-15-9-8-10-19(22)16-17-23(18)25(24,20-11-4-2-5-12-20)21-13-6-3-7-14-21/h2-17H,1H3.
What are the key properties of 2-diphenylphosphoryl-1-methylnaphthalene?
2-diphenylphosphoryl-1-methylnaphthalene has a molecular weight of 342.38 g/mol, XLogP of 4.79, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphoryl-1-methylnaphthalene is sourced from PubChem (CID 150613039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).