(3-butylcyclohexen-1-yl)oxy-triethylsilane

C16H32OSi — CID 15254772

IUPAC(3-butylcyclohexen-1-yl)oxy-triethylsilane
SMILESCCCCC1C=C(O[Si](CC)(CC)CC)CCC1
InChIInChI=1S/C16H32OSi/c1-5-9-11-15-12-10-13-16(14-15)17-18(6-2,7-3)8-4/h14-15H,5-13H2,1-4H3
InChIKeyNHAZEEQYHWRZOQ-UHFFFAOYSA-N
MW268.52 g/mol
LogP5.88
Rot. Bonds8

About (3-butylcyclohexen-1-yl)oxy-triethylsilane

(3-butylcyclohexen-1-yl)oxy-triethylsilane (PubChem CID 15254772) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is (3-butylcyclohexen-1-yl)oxy-triethylsilane.

Molecular Properties

Compound Name(3-butylcyclohexen-1-yl)oxy-triethylsilane
PubChem CID15254772
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Name(3-butylcyclohexen-1-yl)oxy-triethylsilane
SMILESCCCCC1C=C(O[Si](CC)(CC)CC)CCC1
InChIInChI=1S/C16H32OSi/c1-5-9-11-15-12-10-13-16(14-15)17-18(6-2,7-3)8-4/h14-15H,5-13H2,1-4H3
InChIKeyNHAZEEQYHWRZOQ-UHFFFAOYSA-N
XLogP5.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 (3-butylcyclohexen-1-yl)oxy-triethylsilane?
The IUPAC name of (3-butylcyclohexen-1-yl)oxy-triethylsilane (CID 15254772) is (3-butylcyclohexen-1-yl)oxy-triethylsilane.
What is the SMILES notation for (3-butylcyclohexen-1-yl)oxy-triethylsilane?
The canonical SMILES for (3-butylcyclohexen-1-yl)oxy-triethylsilane is CCCCC1C=C(O[Si](CC)(CC)CC)CCC1.
What is the InChIKey of (3-butylcyclohexen-1-yl)oxy-triethylsilane?
The InChIKey is NHAZEEQYHWRZOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-5-9-11-15-12-10-13-16(14-15)17-18(6-2,7-3)8-4/h14-15H,5-13H2,1-4H3.
What are the key properties of (3-butylcyclohexen-1-yl)oxy-triethylsilane?
(3-butylcyclohexen-1-yl)oxy-triethylsilane has a molecular weight of 268.52 g/mol, XLogP of 5.88, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-butylcyclohexen-1-yl)oxy-triethylsilane is sourced from PubChem (CID 15254772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).