tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane

C14H26O3Si — CID 134892749

IUPACtert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane
SMILESC=C[C@@H]1OC(O[Si](C)(C)C(C)(C)C)=CC[C@H]1OC
InChIInChI=1S/C14H26O3Si/c1-8-11-12(15-5)9-10-13(16-11)17-18(6,7)14(2,3)4/h8,10-12H,1,9H2,2-7H3/t11-,12+/m0/s1
InChIKeyHHSIXWIKGTUZSS-NWDGAFQWSA-N
MW270.44 g/mol
LogP3.84
Rot. Bonds4

About tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane

tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane (PubChem CID 134892749) has the molecular formula C14H26O3Si and a molecular weight of 270.44 g/mol. Its IUPAC name is tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane
PubChem CID134892749
Molecular FormulaC14H26O3Si
Molecular Weight270.44 g/mol
Exact Mass270.17
IUPAC Nametert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane
SMILESC=C[C@@H]1OC(O[Si](C)(C)C(C)(C)C)=CC[C@H]1OC
InChIInChI=1S/C14H26O3Si/c1-8-11-12(15-5)9-10-13(16-11)17-18(6,7)14(2,3)4/h8,10-12H,1,9H2,2-7H3/t11-,12+/m0/s1
InChIKeyHHSIXWIKGTUZSS-NWDGAFQWSA-N
XLogP3.84
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.44
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane 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-[(2R,3R,4R)-2-ethenyl-4-methoxyoxolan-3-yl]oxy-dimethylsilane
CID 178070071
tert-butyl-dimethyl-(4-prop-2-enylcyclohexa-1,5-dien-1-yl)oxysilane
CID 91574746
tert-butyl-(3-ethenyl-2-methylcyclopenten-1-yl)oxy-dimethylsilane
CID 101362694
(4R,5R,6R)-4-[tert-butyl(dimethyl)silyl]oxy-6-ethenyl-5-[(4-methoxyphenyl)methoxy]oxan-2-one
CID 101429250
2-[tert-butyl(dimethyl)silyl]oxy-1-prop-2-enylcyclopent-2-en-1-ol
CID 135044795
tert-butyl-dimethyl-(4-methylcyclopenta-1,4-dien-1-yl)oxysilane
CID 14838981
tert-butyl-(2-ethenyl-4-methoxyphenoxy)-dimethylsilane
CID 10945326
[(1R,2S,3aS)-1-ethenyl-1,2,3,3a,4,5-hexahydropentalen-2-yl]oxy-tert-butyl-dimethylsilane
CID 10061373
2-[4-[tert-butyl(dimethyl)silyl]oxycyclohexa-1,3-dien-1-yl]-2-(3-oxocyclopenten-1-yl)propanedinitrile
CID 553888
tert-butyl-[[2-[tert-butyl(dimethyl)silyl]oxy-3,4-dihydropyridin-6-yl]oxy]-dimethylsilane
CID 11121412
tert-butyl-dimethyl-pyrimidin-2-yloxysilane
CID 90318512
methyl (1S,2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-5-oxo-2-prop-2-enylcyclohexane-1-carboxylate
CID 102066658

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane (CID 134892749) is tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane is C=C[C@@H]1OC(O[Si](C)(C)C(C)(C)C)=CC[C@H]1OC.
What is the InChIKey of tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane?
The InChIKey is HHSIXWIKGTUZSS-NWDGAFQWSA-N. The full InChI is InChI=1S/C14H26O3Si/c1-8-11-12(15-5)9-10-13(16-11)17-18(6,7)14(2,3)4/h8,10-12H,1,9H2,2-7H3/t11-,12+/m0/s1.
What are the key properties of tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane?
tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane has a molecular weight of 270.44 g/mol, XLogP of 3.84, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(2S,3R)-2-ethenyl-3-methoxy-3,4-dihydro-2H-pyran-6-yl]oxy]-dimethylsilane is sourced from PubChem (CID 134892749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).