1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane

C11H22OSi — CID 174174043

IUPAC1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC12CC(C1)C2
InChIInChI=1S/C11H22OSi/c1-10(2,3)13(4,5)12-11-6-9(7-11)8-11/h9H,6-8H2,1-5H3
InChIKeyOGJLPMMMCAFECT-UHFFFAOYSA-N
MW198.38 g/mol
LogP3.56
Rot. Bonds2

About 1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane

1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane (PubChem CID 174174043) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is 1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane
PubChem CID174174043
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC12CC(C1)C2
InChIInChI=1S/C11H22OSi/c1-10(2,3)13(4,5)12-11-6-9(7-11)8-11/h9H,6-8H2,1-5H3
InChIKeyOGJLPMMMCAFECT-UHFFFAOYSA-N
XLogP3.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane?
The IUPAC name of 1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane (CID 174174043) is 1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane.
What is the SMILES notation for 1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane?
The canonical SMILES for 1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane is CC(C)(C)[Si](C)(C)OC12CC(C1)C2.
What is the InChIKey of 1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane?
The InChIKey is OGJLPMMMCAFECT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22OSi/c1-10(2,3)13(4,5)12-11-6-9(7-11)8-11/h9H,6-8H2,1-5H3.
What are the key properties of 1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane?
1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane has a molecular weight of 198.38 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bicyclo[1.1.1]pentanyloxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 174174043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).