(6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane

C16H32OSi — CID 10400860

IUPAC(6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane
SMILESCCCCCCC12CCCCC1(O[Si](C)(C)C)C2
InChIInChI=1S/C16H32OSi/c1-5-6-7-8-11-15-12-9-10-13-16(15,14-15)17-18(2,3)4/h5-14H2,1-4H3
InChIKeyXDFYFKQAKDTJLG-UHFFFAOYSA-N
MW268.52 g/mol
LogP5.51
Rot. Bonds7

About (6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane

(6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane (PubChem CID 10400860) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is (6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane.

Molecular Properties

Compound Name(6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane
PubChem CID10400860
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Name(6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane
SMILESCCCCCCC12CCCCC1(O[Si](C)(C)C)C2
InChIInChI=1S/C16H32OSi/c1-5-6-7-8-11-15-12-9-10-13-16(15,14-15)17-18(2,3)4/h5-14H2,1-4H3
InChIKeyXDFYFKQAKDTJLG-UHFFFAOYSA-N
XLogP5.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane?
The IUPAC name of (6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane (CID 10400860) is (6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane.
What is the SMILES notation for (6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane?
The canonical SMILES for (6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane is CCCCCCC12CCCCC1(O[Si](C)(C)C)C2.
What is the InChIKey of (6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane?
The InChIKey is XDFYFKQAKDTJLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-5-6-7-8-11-15-12-9-10-13-16(15,14-15)17-18(2,3)4/h5-14H2,1-4H3.
What are the key properties of (6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane?
(6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane has a molecular weight of 268.52 g/mol, XLogP of 5.51, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-hexyl-1-bicyclo[4.1.0]heptanyl)oxy-trimethylsilane is sourced from PubChem (CID 10400860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).