2-(chloromethyl)oxirane;pentachloro-λ5-stibane

C3H5Cl6OSb — CID 91666506

IUPAC2-(chloromethyl)oxirane;pentachloro-λ5-stibane
SMILESClCC1CO1.Cl[Sb](Cl)(Cl)(Cl)Cl
InChIInChI=1S/C3H5ClO.5ClH.Sb/c4-1-3-2-5-3;;;;;;/h3H,1-2H2;5*1H;/q;;;;;;+5/p-5
InChIKeyZLDUCODHECUOPH-UHFFFAOYSA-I
MW391.55 g/mol
LogP3.69
Rot. Bonds1

About 2-(chloromethyl)oxirane;pentachloro-λ5-stibane

2-(chloromethyl)oxirane;pentachloro-λ5-stibane (PubChem CID 91666506) has the molecular formula C3H5Cl6OSb and a molecular weight of 391.55 g/mol. Its IUPAC name is 2-(chloromethyl)oxirane;pentachloro-λ5-stibane.

Molecular Properties

Compound Name2-(chloromethyl)oxirane;pentachloro-λ5-stibane
PubChem CID91666506
Molecular FormulaC3H5Cl6OSb
Molecular Weight391.55 g/mol
Exact Mass387.75
IUPAC Name2-(chloromethyl)oxirane;pentachloro-λ5-stibane
SMILESClCC1CO1.Cl[Sb](Cl)(Cl)(Cl)Cl
InChIInChI=1S/C3H5ClO.5ClH.Sb/c4-1-3-2-5-3;;;;;;/h3H,1-2H2;5*1H;/q;;;;;;+5/p-5
InChIKeyZLDUCODHECUOPH-UHFFFAOYSA-I
XLogP3.69
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.55
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(chloromethyl)oxirane;pentachloro-λ5-stibane?
The IUPAC name of 2-(chloromethyl)oxirane;pentachloro-λ5-stibane (CID 91666506) is 2-(chloromethyl)oxirane;pentachloro-λ5-stibane.
What is the SMILES notation for 2-(chloromethyl)oxirane;pentachloro-λ5-stibane?
The canonical SMILES for 2-(chloromethyl)oxirane;pentachloro-λ5-stibane is ClCC1CO1.Cl[Sb](Cl)(Cl)(Cl)Cl.
What is the InChIKey of 2-(chloromethyl)oxirane;pentachloro-λ5-stibane?
The InChIKey is ZLDUCODHECUOPH-UHFFFAOYSA-I. The full InChI is InChI=1S/C3H5ClO.5ClH.Sb/c4-1-3-2-5-3;;;;;;/h3H,1-2H2;5*1H;/q;;;;;;+5/p-5.
What are the key properties of 2-(chloromethyl)oxirane;pentachloro-λ5-stibane?
2-(chloromethyl)oxirane;pentachloro-λ5-stibane has a molecular weight of 391.55 g/mol, XLogP of 3.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(chloromethyl)oxirane;pentachloro-λ5-stibane is sourced from PubChem (CID 91666506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).