dichloro-(4-chlorophenoxy)phosphane

C6H4Cl3OP — CID 4185151

IUPACdichloro-(4-chlorophenoxy)phosphane
SMILESClc1ccc(OP(Cl)Cl)cc1
InChIInChI=1S/C6H4Cl3OP/c7-5-1-3-6(4-2-5)10-11(8)9/h1-4H
InChIKeyPIMBQOMNSAWHJF-UHFFFAOYSA-N
MW229.43 g/mol
LogP4.42
Rot. Bonds2

About dichloro-(4-chlorophenoxy)phosphane

dichloro-(4-chlorophenoxy)phosphane (PubChem CID 4185151) has the molecular formula C6H4Cl3OP and a molecular weight of 229.43 g/mol. Its IUPAC name is dichloro-(4-chlorophenoxy)phosphane.

Molecular Properties

Compound Namedichloro-(4-chlorophenoxy)phosphane
PubChem CID4185151
Molecular FormulaC6H4Cl3OP
Molecular Weight229.43 g/mol
Exact Mass227.91
IUPAC Namedichloro-(4-chlorophenoxy)phosphane
SMILESClc1ccc(OP(Cl)Cl)cc1
InChIInChI=1S/C6H4Cl3OP/c7-5-1-3-6(4-2-5)10-11(8)9/h1-4H
InChIKeyPIMBQOMNSAWHJF-UHFFFAOYSA-N
XLogP4.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.43
LogP ≤ 54.42
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 dichloro-(4-chlorophenoxy)phosphane?
The IUPAC name of dichloro-(4-chlorophenoxy)phosphane (CID 4185151) is dichloro-(4-chlorophenoxy)phosphane.
What is the SMILES notation for dichloro-(4-chlorophenoxy)phosphane?
The canonical SMILES for dichloro-(4-chlorophenoxy)phosphane is Clc1ccc(OP(Cl)Cl)cc1.
What is the InChIKey of dichloro-(4-chlorophenoxy)phosphane?
The InChIKey is PIMBQOMNSAWHJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl3OP/c7-5-1-3-6(4-2-5)10-11(8)9/h1-4H.
What are the key properties of dichloro-(4-chlorophenoxy)phosphane?
dichloro-(4-chlorophenoxy)phosphane has a molecular weight of 229.43 g/mol, XLogP of 4.42, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-(4-chlorophenoxy)phosphane is sourced from PubChem (CID 4185151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).