1-bicyclo[2.2.1]heptanyl(triethyl)silane

C13H26Si — CID 142641606

IUPAC1-bicyclo[2.2.1]heptanyl(triethyl)silane
SMILESCC[Si](CC)(CC)C12CCC(CC1)C2
InChIInChI=1S/C13H26Si/c1-4-14(5-2,6-3)13-9-7-12(11-13)8-10-13/h12H,4-11H2,1-3H3
InChIKeyDTGUTSIHDQBYAJ-UHFFFAOYSA-N
MW210.44 g/mol
LogP4.83
Rot. Bonds4

About 1-bicyclo[2.2.1]heptanyl(triethyl)silane

1-bicyclo[2.2.1]heptanyl(triethyl)silane (PubChem CID 142641606) has the molecular formula C13H26Si and a molecular weight of 210.44 g/mol. Its IUPAC name is 1-bicyclo[2.2.1]heptanyl(triethyl)silane.

Molecular Properties

Compound Name1-bicyclo[2.2.1]heptanyl(triethyl)silane
PubChem CID142641606
Molecular FormulaC13H26Si
Molecular Weight210.44 g/mol
Exact Mass210.18
IUPAC Name1-bicyclo[2.2.1]heptanyl(triethyl)silane
SMILESCC[Si](CC)(CC)C12CCC(CC1)C2
InChIInChI=1S/C13H26Si/c1-4-14(5-2,6-3)13-9-7-12(11-13)8-10-13/h12H,4-11H2,1-3H3
InChIKeyDTGUTSIHDQBYAJ-UHFFFAOYSA-N
XLogP4.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.44
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 1-bicyclo[2.2.1]heptanyl(triethyl)silane?
The IUPAC name of 1-bicyclo[2.2.1]heptanyl(triethyl)silane (CID 142641606) is 1-bicyclo[2.2.1]heptanyl(triethyl)silane.
What is the SMILES notation for 1-bicyclo[2.2.1]heptanyl(triethyl)silane?
The canonical SMILES for 1-bicyclo[2.2.1]heptanyl(triethyl)silane is CC[Si](CC)(CC)C12CCC(CC1)C2.
What is the InChIKey of 1-bicyclo[2.2.1]heptanyl(triethyl)silane?
The InChIKey is DTGUTSIHDQBYAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26Si/c1-4-14(5-2,6-3)13-9-7-12(11-13)8-10-13/h12H,4-11H2,1-3H3.
What are the key properties of 1-bicyclo[2.2.1]heptanyl(triethyl)silane?
1-bicyclo[2.2.1]heptanyl(triethyl)silane has a molecular weight of 210.44 g/mol, XLogP of 4.83, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bicyclo[2.2.1]heptanyl(triethyl)silane is sourced from PubChem (CID 142641606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).