2-chloro-2,4,5,5,6,6-hexamethyloxasilinane

C10H21ClOSi — CID 70010408

IUPAC2-chloro-2,4,5,5,6,6-hexamethyloxasilinane
SMILESCC1C[Si](C)(Cl)OC(C)(C)C1(C)C
InChIInChI=1S/C10H21ClOSi/c1-8-7-13(6,11)12-10(4,5)9(8,2)3/h8H,7H2,1-6H3
InChIKeyZKKKRGNBIIPPEC-UHFFFAOYSA-N
MW220.82 g/mol
LogP3.77
Rot. Bonds

About 2-chloro-2,4,5,5,6,6-hexamethyloxasilinane

2-chloro-2,4,5,5,6,6-hexamethyloxasilinane (PubChem CID 70010408) has the molecular formula C10H21ClOSi and a molecular weight of 220.82 g/mol. Its IUPAC name is 2-chloro-2,4,5,5,6,6-hexamethyloxasilinane.

Molecular Properties

Compound Name2-chloro-2,4,5,5,6,6-hexamethyloxasilinane
PubChem CID70010408
Molecular FormulaC10H21ClOSi
Molecular Weight220.82 g/mol
Exact Mass220.11
IUPAC Name2-chloro-2,4,5,5,6,6-hexamethyloxasilinane
SMILESCC1C[Si](C)(Cl)OC(C)(C)C1(C)C
InChIInChI=1S/C10H21ClOSi/c1-8-7-13(6,11)12-10(4,5)9(8,2)3/h8H,7H2,1-6H3
InChIKeyZKKKRGNBIIPPEC-UHFFFAOYSA-N
XLogP3.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.82
LogP ≤ 53.77
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-chloro-2,4,5,5,6,6-hexamethyloxasilinane?
The IUPAC name of 2-chloro-2,4,5,5,6,6-hexamethyloxasilinane (CID 70010408) is 2-chloro-2,4,5,5,6,6-hexamethyloxasilinane.
What is the SMILES notation for 2-chloro-2,4,5,5,6,6-hexamethyloxasilinane?
The canonical SMILES for 2-chloro-2,4,5,5,6,6-hexamethyloxasilinane is CC1C[Si](C)(Cl)OC(C)(C)C1(C)C.
What is the InChIKey of 2-chloro-2,4,5,5,6,6-hexamethyloxasilinane?
The InChIKey is ZKKKRGNBIIPPEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21ClOSi/c1-8-7-13(6,11)12-10(4,5)9(8,2)3/h8H,7H2,1-6H3.
What are the key properties of 2-chloro-2,4,5,5,6,6-hexamethyloxasilinane?
2-chloro-2,4,5,5,6,6-hexamethyloxasilinane has a molecular weight of 220.82 g/mol, XLogP of 3.77, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-2,4,5,5,6,6-hexamethyloxasilinane is sourced from PubChem (CID 70010408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).