chloro-(2-chlorophenyl)-diphenylphosphanium

C18H14Cl2P+ — CID 141327691

IUPACchloro-(2-chlorophenyl)-diphenylphosphanium
SMILESClc1ccccc1[P+](Cl)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H14Cl2P/c19-17-13-7-8-14-18(17)21(20,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H/q+1
InChIKeySTTSBHXFACZVLM-UHFFFAOYSA-N
MW332.19 g/mol
LogP4.79
Rot. Bonds3

About chloro-(2-chlorophenyl)-diphenylphosphanium

chloro-(2-chlorophenyl)-diphenylphosphanium (PubChem CID 141327691) has the molecular formula C18H14Cl2P+ and a molecular weight of 332.19 g/mol. Its IUPAC name is chloro-(2-chlorophenyl)-diphenylphosphanium.

Molecular Properties

Compound Namechloro-(2-chlorophenyl)-diphenylphosphanium
PubChem CID141327691
Molecular FormulaC18H14Cl2P+
Molecular Weight332.19 g/mol
Exact Mass331.02
IUPAC Namechloro-(2-chlorophenyl)-diphenylphosphanium
SMILESClc1ccccc1[P+](Cl)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H14Cl2P/c19-17-13-7-8-14-18(17)21(20,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H/q+1
InChIKeySTTSBHXFACZVLM-UHFFFAOYSA-N
XLogP4.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.19
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze chloro-(2-chlorophenyl)-diphenylphosphanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of chloro-(2-chlorophenyl)-diphenylphosphanium?
The IUPAC name of chloro-(2-chlorophenyl)-diphenylphosphanium (CID 141327691) is chloro-(2-chlorophenyl)-diphenylphosphanium.
What is the SMILES notation for chloro-(2-chlorophenyl)-diphenylphosphanium?
The canonical SMILES for chloro-(2-chlorophenyl)-diphenylphosphanium is Clc1ccccc1[P+](Cl)(c1ccccc1)c1ccccc1.
What is the InChIKey of chloro-(2-chlorophenyl)-diphenylphosphanium?
The InChIKey is STTSBHXFACZVLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2P/c19-17-13-7-8-14-18(17)21(20,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H/q+1.
What are the key properties of chloro-(2-chlorophenyl)-diphenylphosphanium?
chloro-(2-chlorophenyl)-diphenylphosphanium has a molecular weight of 332.19 g/mol, XLogP of 4.79, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(2-chlorophenyl)-diphenylphosphanium is sourced from PubChem (CID 141327691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).