triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane

C13H22O2Si — CID 10657595

IUPACtriethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane
SMILESCC[Si](CC)(CC)OC1=C[C@H]2C=C[C@@H](C1)O2
InChIInChI=1S/C13H22O2Si/c1-4-16(5-2,6-3)15-13-9-11-7-8-12(10-13)14-11/h7-9,11-12H,4-6,10H2,1-3H3/t11-,12+/m1/s1
InChIKeyJNINITZODOFXAF-NEPJUHHUSA-N
MW238.40 g/mol
LogP3.62
Rot. Bonds5

About triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane

triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane (PubChem CID 10657595) has the molecular formula C13H22O2Si and a molecular weight of 238.40 g/mol. Its IUPAC name is triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane.

Molecular Properties

Compound Nametriethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane
PubChem CID10657595
Molecular FormulaC13H22O2Si
Molecular Weight238.40 g/mol
Exact Mass238.14
IUPAC Nametriethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane
SMILESCC[Si](CC)(CC)OC1=C[C@H]2C=C[C@@H](C1)O2
InChIInChI=1S/C13H22O2Si/c1-4-16(5-2,6-3)15-13-9-11-7-8-12(10-13)14-11/h7-9,11-12H,4-6,10H2,1-3H3/t11-,12+/m1/s1
InChIKeyJNINITZODOFXAF-NEPJUHHUSA-N
XLogP3.62
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Silane, [(3,6-dihydro-2H-pyran-4-yl)oxy]trimethyl-
CID 11095099
2-(2,5-Dihydrofuran-2-yl)ethoxy-tri(propan-2-yl)silane
CID 10540004
Tert-butyl-dimethyl-(2,3,4,7-tetrahydrooxepin-7-ylmethoxy)silane
CID 102504792
tert-butyl-[(1S)-1-(3-methoxy-2,5-dihydrofuran-2-yl)ethoxy]-dimethylsilane
CID 134836061
(3-Methoxycyclohexa-1,4-dien-1-yl)oxy-dimethyl-propan-2-ylsilane
CID 134906247
Tert-butyl-(3-methoxycyclohexa-1,4-dien-1-yl)oxy-dimethylsilane
CID 134906464
[2-(Ethoxymethyl)cyclohexa-1,3-dien-1-yl]oxy-triethylsilane
CID 176427842
tert-butyl-dimethyl-[[(1R,2R,5S)-3-triethylsilyloxy-8-oxabicyclo[3.2.1]octa-3,6-dien-2-yl]oxy]silane
CID 11257174
tert-butyl-[(1S)-1-[(2S)-3-methoxy-2,5-dihydrofuran-2-yl]ethoxy]-dimethylsilane
CID 102055862
tert-butyl-[(1R,4S)-4-methoxycyclopent-2-en-1-yl]oxy-dimethylsilane
CID 10728073
tert-Butyl-(3,6-dihydro-2H-pyran-4-yloxy)dimethylsilane
CID 15941458
tert-butyl-dimethyl-[2-(5-methyl-3,6-dihydro-2H-pyran-2-yl)ethoxy]silane
CID 21986090

Frequently Asked Questions

What is the IUPAC name of triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane?
The IUPAC name of triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane (CID 10657595) is triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane.
What is the SMILES notation for triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane?
The canonical SMILES for triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane is CC[Si](CC)(CC)OC1=C[C@H]2C=C[C@@H](C1)O2.
What is the InChIKey of triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane?
The InChIKey is JNINITZODOFXAF-NEPJUHHUSA-N. The full InChI is InChI=1S/C13H22O2Si/c1-4-16(5-2,6-3)15-13-9-11-7-8-12(10-13)14-11/h7-9,11-12H,4-6,10H2,1-3H3/t11-,12+/m1/s1.
What are the key properties of triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane?
triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane has a molecular weight of 238.40 g/mol, XLogP of 3.62, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[[(1R,5R)-8-oxabicyclo[3.2.1]octa-2,6-dien-3-yl]oxy]silane is sourced from PubChem (CID 10657595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).