5,6-dichloro-2,2-diethoxyoxasilinane

C8H16Cl2O3Si — CID 66904915

IUPAC5,6-dichloro-2,2-diethoxyoxasilinane
SMILESCCO[Si]1(OCC)CCC(Cl)C(Cl)O1
InChIInChI=1S/C8H16Cl2O3Si/c1-3-11-14(12-4-2)6-5-7(9)8(10)13-14/h7-8H,3-6H2,1-2H3
InChIKeyWCGNFRCBCZXAMM-UHFFFAOYSA-N
MW259.20 g/mol
LogP2.59
Rot. Bonds4

About 5,6-dichloro-2,2-diethoxyoxasilinane

5,6-dichloro-2,2-diethoxyoxasilinane (PubChem CID 66904915) has the molecular formula C8H16Cl2O3Si and a molecular weight of 259.20 g/mol. Its IUPAC name is 5,6-dichloro-2,2-diethoxyoxasilinane.

Molecular Properties

Compound Name5,6-dichloro-2,2-diethoxyoxasilinane
PubChem CID66904915
Molecular FormulaC8H16Cl2O3Si
Molecular Weight259.20 g/mol
Exact Mass258.02
IUPAC Name5,6-dichloro-2,2-diethoxyoxasilinane
SMILESCCO[Si]1(OCC)CCC(Cl)C(Cl)O1
InChIInChI=1S/C8H16Cl2O3Si/c1-3-11-14(12-4-2)6-5-7(9)8(10)13-14/h7-8H,3-6H2,1-2H3
InChIKeyWCGNFRCBCZXAMM-UHFFFAOYSA-N
XLogP2.59
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.20
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-2,2-diethoxyoxasilinane?
The IUPAC name of 5,6-dichloro-2,2-diethoxyoxasilinane (CID 66904915) is 5,6-dichloro-2,2-diethoxyoxasilinane.
What is the SMILES notation for 5,6-dichloro-2,2-diethoxyoxasilinane?
The canonical SMILES for 5,6-dichloro-2,2-diethoxyoxasilinane is CCO[Si]1(OCC)CCC(Cl)C(Cl)O1.
What is the InChIKey of 5,6-dichloro-2,2-diethoxyoxasilinane?
The InChIKey is WCGNFRCBCZXAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16Cl2O3Si/c1-3-11-14(12-4-2)6-5-7(9)8(10)13-14/h7-8H,3-6H2,1-2H3.
What are the key properties of 5,6-dichloro-2,2-diethoxyoxasilinane?
5,6-dichloro-2,2-diethoxyoxasilinane has a molecular weight of 259.20 g/mol, XLogP of 2.59, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-2,2-diethoxyoxasilinane is sourced from PubChem (CID 66904915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).