2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane

C12H24Cl2OSi — CID 23297343

IUPAC2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane
SMILESCC1(C)O[Si](Cl)(Cl)C(C)(C)C(C)(C)C1(C)C
InChIInChI=1S/C12H24Cl2OSi/c1-9(2)10(3,4)12(7,8)16(13,14)15-11(9,5)6/h1-8H3
InChIKeyZZFLQWQHLDLRBH-UHFFFAOYSA-N
MW283.31 g/mol
LogP5.04
Rot. Bonds

About 2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane

2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane (PubChem CID 23297343) has the molecular formula C12H24Cl2OSi and a molecular weight of 283.31 g/mol. Its IUPAC name is 2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane.

Molecular Properties

Compound Name2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane
PubChem CID23297343
Molecular FormulaC12H24Cl2OSi
Molecular Weight283.31 g/mol
Exact Mass282.10
IUPAC Name2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane
SMILESCC1(C)O[Si](Cl)(Cl)C(C)(C)C(C)(C)C1(C)C
InChIInChI=1S/C12H24Cl2OSi/c1-9(2)10(3,4)12(7,8)16(13,14)15-11(9,5)6/h1-8H3
InChIKeyZZFLQWQHLDLRBH-UHFFFAOYSA-N
XLogP5.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.31
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane?
The IUPAC name of 2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane (CID 23297343) is 2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane.
What is the SMILES notation for 2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane?
The canonical SMILES for 2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane is CC1(C)O[Si](Cl)(Cl)C(C)(C)C(C)(C)C1(C)C.
What is the InChIKey of 2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane?
The InChIKey is ZZFLQWQHLDLRBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24Cl2OSi/c1-9(2)10(3,4)12(7,8)16(13,14)15-11(9,5)6/h1-8H3.
What are the key properties of 2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane?
2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane has a molecular weight of 283.31 g/mol, XLogP of 5.04, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dichloro-3,3,4,4,5,5,6,6-octamethyloxasilinane is sourced from PubChem (CID 23297343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).