diethyl(diphenyl)phosphanium hydroxide

C16H21OP — CID 18407746

IUPACdiethyl(diphenyl)phosphanium hydroxide
SMILESCC[P+](CC)(c1ccccc1)c1ccccc1.[OH-]
InChIInChI=1S/C16H20P.H2O/c1-3-17(4-2,15-11-7-5-8-12-15)16-13-9-6-10-14-16;/h5-14H,3-4H2,1-2H3;1H2/q+1;/p-1
InChIKeyRCVPKYNCVPJJFG-UHFFFAOYSA-M
MW260.32 g/mol
LogP3.52
Rot. Bonds4

About diethyl(diphenyl)phosphanium hydroxide

diethyl(diphenyl)phosphanium hydroxide (PubChem CID 18407746) has the molecular formula C16H21OP and a molecular weight of 260.32 g/mol. Its IUPAC name is diethyl(diphenyl)phosphanium hydroxide.

Molecular Properties

Compound Namediethyl(diphenyl)phosphanium hydroxide
PubChem CID18407746
Molecular FormulaC16H21OP
Molecular Weight260.32 g/mol
Exact Mass260.13
IUPAC Namediethyl(diphenyl)phosphanium hydroxide
SMILESCC[P+](CC)(c1ccccc1)c1ccccc1.[OH-]
InChIInChI=1S/C16H20P.H2O/c1-3-17(4-2,15-11-7-5-8-12-15)16-13-9-6-10-14-16;/h5-14H,3-4H2,1-2H3;1H2/q+1;/p-1
InChIKeyRCVPKYNCVPJJFG-UHFFFAOYSA-M
XLogP3.52
TPSA30.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 53.52
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 diethyl(diphenyl)phosphanium hydroxide?
The IUPAC name of diethyl(diphenyl)phosphanium hydroxide (CID 18407746) is diethyl(diphenyl)phosphanium hydroxide.
What is the SMILES notation for diethyl(diphenyl)phosphanium hydroxide?
The canonical SMILES for diethyl(diphenyl)phosphanium hydroxide is CC[P+](CC)(c1ccccc1)c1ccccc1.[OH-].
What is the InChIKey of diethyl(diphenyl)phosphanium hydroxide?
The InChIKey is RCVPKYNCVPJJFG-UHFFFAOYSA-M. The full InChI is InChI=1S/C16H20P.H2O/c1-3-17(4-2,15-11-7-5-8-12-15)16-13-9-6-10-14-16;/h5-14H,3-4H2,1-2H3;1H2/q+1;/p-1.
What are the key properties of diethyl(diphenyl)phosphanium hydroxide?
diethyl(diphenyl)phosphanium hydroxide has a molecular weight of 260.32 g/mol, XLogP of 3.52, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl(diphenyl)phosphanium hydroxide is sourced from PubChem (CID 18407746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).