tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane

C15H28O2Si — CID 135043759

IUPACtert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane
SMILESCC(C)(C)[Si](C)(C)OCC=C1CCC[C@]2(C)O[C@H]12
InChIInChI=1S/C15H28O2Si/c1-14(2,3)18(5,6)16-11-9-12-8-7-10-15(4)13(12)17-15/h9,13H,7-8,10-11H2,1-6H3/t13-,15+/m1/s1
InChIKeyMAYPJPMBPJJHFY-HIFRSBDPSA-N
MW268.47 g/mol
LogP4.28
Rot. Bonds3

About tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane

tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane (PubChem CID 135043759) has the molecular formula C15H28O2Si and a molecular weight of 268.47 g/mol. Its IUPAC name is tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane
PubChem CID135043759
Molecular FormulaC15H28O2Si
Molecular Weight268.47 g/mol
Exact Mass268.19
IUPAC Nametert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane
SMILESCC(C)(C)[Si](C)(C)OCC=C1CCC[C@]2(C)O[C@H]12
InChIInChI=1S/C15H28O2Si/c1-14(2,3)18(5,6)16-11-9-12-8-7-10-15(4)13(12)17-15/h9,13H,7-8,10-11H2,1-6H3/t13-,15+/m1/s1
InChIKeyMAYPJPMBPJJHFY-HIFRSBDPSA-N
XLogP4.28
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.28
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'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]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

tert-butyl-dimethyl-[[(1S,6R)-7-oxabicyclo[4.1.0]hept-2-en-2-yl]methoxy]silane
CID 11241934
Tert-butyl-dimethyl-(7-oxabicyclo[4.1.0]hept-2-en-2-ylmethoxy)silane
CID 12002929
Trimethoxy(2-oxatricyclo[3.2.1.01,3]oct-4-en-6-yl)silane
CID 140207863
Triethoxy(2-oxatricyclo[3.2.1.01,3]oct-4-en-6-yl)silane
CID 140207884
Triethoxy(2-oxatricyclo[3.2.1.01,3]oct-4-en-7-yl)silane
CID 140207888
Trimethoxy(2-oxatricyclo[3.2.1.01,3]oct-4-en-7-yl)silane
CID 140207889
1-Oct-1-enyl-7-oxabicyclo[4.1.0]heptane
CID 174672392
1-(1-ethyl-1H-silol-2-yl)-7-oxabicyclo[4.1.0]heptane
CID 175835039
Tert-butyl-[(6-butyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]-dimethylsilane
CID 11055137
5-(3,3-Dimethylbutylidene)-1-methyl-7-oxabicyclo[4.1.0]heptane
CID 71376772
(2E)-2-[1-[[tert-butyl(dimethyl)silyl]oxymethyl]-7-oxabicyclo[4.1.0]heptan-2-ylidene]acetonitrile
CID 101355054
trimethyl-[(1R,4S,6R)-1-methyl-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]silane
CID 102387711

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane (CID 135043759) is tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane is CC(C)(C)[Si](C)(C)OCC=C1CCC[C@]2(C)O[C@H]12.
What is the InChIKey of tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane?
The InChIKey is MAYPJPMBPJJHFY-HIFRSBDPSA-N. The full InChI is InChI=1S/C15H28O2Si/c1-14(2,3)18(5,6)16-11-9-12-8-7-10-15(4)13(12)17-15/h9,13H,7-8,10-11H2,1-6H3/t13-,15+/m1/s1.
What are the key properties of tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane?
tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane has a molecular weight of 268.47 g/mol, XLogP of 4.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[2-[(1R,6S)-6-methyl-7-oxabicyclo[4.1.0]heptan-2-ylidene]ethoxy]silane is sourced from PubChem (CID 135043759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).