(2-butylcyclohexen-1-yl)oxy-trimethylsilane

C13H26OSi — CID 13217778

IUPAC(2-butylcyclohexen-1-yl)oxy-trimethylsilane
SMILESCCCCC1=C(O[Si](C)(C)C)CCCC1
InChIInChI=1S/C13H26OSi/c1-5-6-9-12-10-7-8-11-13(12)14-15(2,3)4/h5-11H2,1-4H3
InChIKeyVYTDVAJHQPWEAP-UHFFFAOYSA-N
MW226.44 g/mol
LogP4.86
Rot. Bonds5

About (2-butylcyclohexen-1-yl)oxy-trimethylsilane

(2-butylcyclohexen-1-yl)oxy-trimethylsilane (PubChem CID 13217778) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is (2-butylcyclohexen-1-yl)oxy-trimethylsilane.

Molecular Properties

Compound Name(2-butylcyclohexen-1-yl)oxy-trimethylsilane
PubChem CID13217778
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Name(2-butylcyclohexen-1-yl)oxy-trimethylsilane
SMILESCCCCC1=C(O[Si](C)(C)C)CCCC1
InChIInChI=1S/C13H26OSi/c1-5-6-9-12-10-7-8-11-13(12)14-15(2,3)4/h5-11H2,1-4H3
InChIKeyVYTDVAJHQPWEAP-UHFFFAOYSA-N
XLogP4.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.86
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 (2-butylcyclohexen-1-yl)oxy-trimethylsilane?
The IUPAC name of (2-butylcyclohexen-1-yl)oxy-trimethylsilane (CID 13217778) is (2-butylcyclohexen-1-yl)oxy-trimethylsilane.
What is the SMILES notation for (2-butylcyclohexen-1-yl)oxy-trimethylsilane?
The canonical SMILES for (2-butylcyclohexen-1-yl)oxy-trimethylsilane is CCCCC1=C(O[Si](C)(C)C)CCCC1.
What is the InChIKey of (2-butylcyclohexen-1-yl)oxy-trimethylsilane?
The InChIKey is VYTDVAJHQPWEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-5-6-9-12-10-7-8-11-13(12)14-15(2,3)4/h5-11H2,1-4H3.
What are the key properties of (2-butylcyclohexen-1-yl)oxy-trimethylsilane?
(2-butylcyclohexen-1-yl)oxy-trimethylsilane has a molecular weight of 226.44 g/mol, XLogP of 4.86, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-butylcyclohexen-1-yl)oxy-trimethylsilane is sourced from PubChem (CID 13217778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).