(5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane

C13H27BOSi — CID 11776342

IUPAC(5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane
SMILESCCB(CC)C1CCC=C(O[Si](C)(C)C)C1
InChIInChI=1S/C13H27BOSi/c1-6-14(7-2)12-9-8-10-13(11-12)15-16(3,4)5/h10,12H,6-9,11H2,1-5H3
InChIKeyHHCJDHGSLQRCAM-UHFFFAOYSA-N
MW238.26 g/mol
LogP4.81
Rot. Bonds5

About (5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane

(5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane (PubChem CID 11776342) has the molecular formula C13H27BOSi and a molecular weight of 238.26 g/mol. Its IUPAC name is (5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane.

Molecular Properties

Compound Name(5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane
PubChem CID11776342
Molecular FormulaC13H27BOSi
Molecular Weight238.26 g/mol
Exact Mass238.19
IUPAC Name(5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane
SMILESCCB(CC)C1CCC=C(O[Si](C)(C)C)C1
InChIInChI=1S/C13H27BOSi/c1-6-14(7-2)12-9-8-10-13(11-12)15-16(3,4)5/h10,12H,6-9,11H2,1-5H3
InChIKeyHHCJDHGSLQRCAM-UHFFFAOYSA-N
XLogP4.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.26
LogP ≤ 54.81
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 (5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane?
The IUPAC name of (5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane (CID 11776342) is (5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane.
What is the SMILES notation for (5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane?
The canonical SMILES for (5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane is CCB(CC)C1CCC=C(O[Si](C)(C)C)C1.
What is the InChIKey of (5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane?
The InChIKey is HHCJDHGSLQRCAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27BOSi/c1-6-14(7-2)12-9-8-10-13(11-12)15-16(3,4)5/h10,12H,6-9,11H2,1-5H3.
What are the key properties of (5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane?
(5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane has a molecular weight of 238.26 g/mol, XLogP of 4.81, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-diethylboranylcyclohexen-1-yl)oxy-trimethylsilane is sourced from PubChem (CID 11776342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).