[2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane

C14H28O2Si — CID 123425987

IUPAC[2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane
SMILESCCC(C)(C[SiH](OC)OC)C12CCC(CC1)C2
InChIInChI=1S/C14H28O2Si/c1-5-13(2,11-17(15-3)16-4)14-8-6-12(10-14)7-9-14/h12,17H,5-11H2,1-4H3
InChIKeyBYOBJNCSYZKEDE-UHFFFAOYSA-N
MW256.46 g/mol
LogP3.50
Rot. Bonds6

About [2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane

[2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane (PubChem CID 123425987) has the molecular formula C14H28O2Si and a molecular weight of 256.46 g/mol. Its IUPAC name is [2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane.

Molecular Properties

Compound Name[2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane
PubChem CID123425987
Molecular FormulaC14H28O2Si
Molecular Weight256.46 g/mol
Exact Mass256.19
IUPAC Name[2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane
SMILESCCC(C)(C[SiH](OC)OC)C12CCC(CC1)C2
InChIInChI=1S/C14H28O2Si/c1-5-13(2,11-17(15-3)16-4)14-8-6-12(10-14)7-9-14/h12,17H,5-11H2,1-4H3
InChIKeyBYOBJNCSYZKEDE-UHFFFAOYSA-N
XLogP3.50
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.46
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane?
The IUPAC name of [2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane (CID 123425987) is [2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane.
What is the SMILES notation for [2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane?
The canonical SMILES for [2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane is CCC(C)(C[SiH](OC)OC)C12CCC(CC1)C2.
What is the InChIKey of [2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane?
The InChIKey is BYOBJNCSYZKEDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2Si/c1-5-13(2,11-17(15-3)16-4)14-8-6-12(10-14)7-9-14/h12,17H,5-11H2,1-4H3.
What are the key properties of [2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane?
[2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane has a molecular weight of 256.46 g/mol, XLogP of 3.50, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-bicyclo[2.2.1]heptanyl)-2-methylbutyl]-dimethoxysilane is sourced from PubChem (CID 123425987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).