bis(2-bromoethoxy)-chlorophosphane

C4H8Br2ClO2P — CID 54551288

IUPACbis(2-bromoethoxy)-chlorophosphane
SMILESClP(OCCBr)OCCBr
InChIInChI=1S/C4H8Br2ClO2P/c5-1-3-8-10(7)9-4-2-6/h1-4H2
InChIKeyZKBPLOSBPFZUHN-UHFFFAOYSA-N
MW314.34 g/mol
LogP3.28
Rot. Bonds6

About bis(2-bromoethoxy)-chlorophosphane

bis(2-bromoethoxy)-chlorophosphane (PubChem CID 54551288) has the molecular formula C4H8Br2ClO2P and a molecular weight of 314.34 g/mol. Its IUPAC name is bis(2-bromoethoxy)-chlorophosphane.

Molecular Properties

Compound Namebis(2-bromoethoxy)-chlorophosphane
PubChem CID54551288
Molecular FormulaC4H8Br2ClO2P
Molecular Weight314.34 g/mol
Exact Mass311.83
IUPAC Namebis(2-bromoethoxy)-chlorophosphane
SMILESClP(OCCBr)OCCBr
InChIInChI=1S/C4H8Br2ClO2P/c5-1-3-8-10(7)9-4-2-6/h1-4H2
InChIKeyZKBPLOSBPFZUHN-UHFFFAOYSA-N
XLogP3.28
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 53.28
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 bis(2-bromoethoxy)-chlorophosphane?
The IUPAC name of bis(2-bromoethoxy)-chlorophosphane (CID 54551288) is bis(2-bromoethoxy)-chlorophosphane.
What is the SMILES notation for bis(2-bromoethoxy)-chlorophosphane?
The canonical SMILES for bis(2-bromoethoxy)-chlorophosphane is ClP(OCCBr)OCCBr.
What is the InChIKey of bis(2-bromoethoxy)-chlorophosphane?
The InChIKey is ZKBPLOSBPFZUHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8Br2ClO2P/c5-1-3-8-10(7)9-4-2-6/h1-4H2.
What are the key properties of bis(2-bromoethoxy)-chlorophosphane?
bis(2-bromoethoxy)-chlorophosphane has a molecular weight of 314.34 g/mol, XLogP of 3.28, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-bromoethoxy)-chlorophosphane is sourced from PubChem (CID 54551288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).