chloro-bis(2-chloroethoxy)phosphane

C4H8Cl3O2P — CID 15518883

IUPACchloro-bis(2-chloroethoxy)phosphane
SMILESClCCOP(Cl)OCCCl
InChIInChI=1S/C4H8Cl3O2P/c5-1-3-8-10(7)9-4-2-6/h1-4H2
InChIKeyQBOBFSGHAHQYNU-UHFFFAOYSA-N
MW225.44 g/mol
LogP2.96
Rot. Bonds6

About chloro-bis(2-chloroethoxy)phosphane

chloro-bis(2-chloroethoxy)phosphane (PubChem CID 15518883) has the molecular formula C4H8Cl3O2P and a molecular weight of 225.44 g/mol. Its IUPAC name is chloro-bis(2-chloroethoxy)phosphane.

Molecular Properties

Compound Namechloro-bis(2-chloroethoxy)phosphane
PubChem CID15518883
Molecular FormulaC4H8Cl3O2P
Molecular Weight225.44 g/mol
Exact Mass223.93
IUPAC Namechloro-bis(2-chloroethoxy)phosphane
SMILESClCCOP(Cl)OCCCl
InChIInChI=1S/C4H8Cl3O2P/c5-1-3-8-10(7)9-4-2-6/h1-4H2
InChIKeyQBOBFSGHAHQYNU-UHFFFAOYSA-N
XLogP2.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.44
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-bis(2-chloroethoxy)phosphane?
The IUPAC name of chloro-bis(2-chloroethoxy)phosphane (CID 15518883) is chloro-bis(2-chloroethoxy)phosphane.
What is the SMILES notation for chloro-bis(2-chloroethoxy)phosphane?
The canonical SMILES for chloro-bis(2-chloroethoxy)phosphane is ClCCOP(Cl)OCCCl.
What is the InChIKey of chloro-bis(2-chloroethoxy)phosphane?
The InChIKey is QBOBFSGHAHQYNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8Cl3O2P/c5-1-3-8-10(7)9-4-2-6/h1-4H2.
What are the key properties of chloro-bis(2-chloroethoxy)phosphane?
chloro-bis(2-chloroethoxy)phosphane has a molecular weight of 225.44 g/mol, XLogP of 2.96, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-bis(2-chloroethoxy)phosphane is sourced from PubChem (CID 15518883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).