[(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane

C19H32O2Si2 — CID 11428026

IUPAC[(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane
SMILESC=C[C@@H]1[C@H](O[Si](C)(C)C)C[C@@H](c2ccccc2)O[Si]1(CC)CC
InChIInChI=1S/C19H32O2Si2/c1-7-19-18(20-22(4,5)6)15-17(16-13-11-10-12-14-16)21-23(19,8-2)9-3/h7,10-14,17-19H,1,8-9,15H2,2-6H3/t17-,18+,19+/m0/s1
InChIKeyFHLHPSISOUDXNX-IPMKNSEASA-N
MW348.63 g/mol
LogP5.91
Rot. Bonds6

About [(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane

[(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane (PubChem CID 11428026) has the molecular formula C19H32O2Si2 and a molecular weight of 348.63 g/mol. Its IUPAC name is [(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane
PubChem CID11428026
Molecular FormulaC19H32O2Si2
Molecular Weight348.63 g/mol
Exact Mass348.19
IUPAC Name[(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane
SMILESC=C[C@@H]1[C@H](O[Si](C)(C)C)C[C@@H](c2ccccc2)O[Si]1(CC)CC
InChIInChI=1S/C19H32O2Si2/c1-7-19-18(20-22(4,5)6)15-17(16-13-11-10-12-14-16)21-23(19,8-2)9-3/h7,10-14,17-19H,1,8-9,15H2,2-6H3/t17-,18+,19+/m0/s1
InChIKeyFHLHPSISOUDXNX-IPMKNSEASA-N
XLogP5.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.63
LogP ≤ 55.91
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'}

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Related Compounds

[(3R,4R,6S)-3-ethenyl-6-phenyl-2,2-di(propan-2-yl)oxasilinan-4-yl]oxy-trimethylsilane
CID 102519223
2,4-diethyl-6-phenyl-1,3-dioxane
CID 71439891
(3R,3aR,5R,6R,7S,7aS)-3-ethenyl-2,2-diethyl-6,7-bis(phenylmethoxy)-5-(phenylmethoxymethyl)-3,3a,5,6,7,7a-hexahydrooxasilolo[4,5-b]pyran
CID 11444345
2-(4-phenyloxetan-2-yl)ethyl prop-2-enoate
CID 141157512
2-phenyloxirane;3-prop-2-enoxyprop-1-ene
CID 87729483
(4R,6S)-3-ethenylidene-2,2-diethyl-6-phenyloxasilinan-4-ol
CID 24807343
[(2R,3R,5R)-5-benzyl-2-prop-2-enyloxolan-3-yl]oxy-tert-butyl-dimethylsilane
CID 42643409
(2S,5R)-2-ethyl-5-phenyloxolane
CID 102280065
tert-butyl-diphenyl-[[(2R,3S,5R)-5-phenyl-3-phenylmethoxyoxolan-2-yl]methoxy]silane
CID 102482306
[(2S,3S,4S,6S)-3-acetyloxy-2-methyl-6-phenyloxan-4-yl] acetate
CID 10039969
(3R,5R)-5-phenyl-3-prop-2-enyl-1,2-oxazolidine
CID 100981760
(2R,4R)-4-phenyl-2-prop-2-enyl-1,3-dioxane
CID 71376459

Frequently Asked Questions

What is the IUPAC name of [(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane?
The IUPAC name of [(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane (CID 11428026) is [(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane.
What is the SMILES notation for [(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane?
The canonical SMILES for [(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane is C=C[C@@H]1[C@H](O[Si](C)(C)C)C[C@@H](c2ccccc2)O[Si]1(CC)CC.
What is the InChIKey of [(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane?
The InChIKey is FHLHPSISOUDXNX-IPMKNSEASA-N. The full InChI is InChI=1S/C19H32O2Si2/c1-7-19-18(20-22(4,5)6)15-17(16-13-11-10-12-14-16)21-23(19,8-2)9-3/h7,10-14,17-19H,1,8-9,15H2,2-6H3/t17-,18+,19+/m0/s1.
What are the key properties of [(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane?
[(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane has a molecular weight of 348.63 g/mol, XLogP of 5.91, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R,4R,6S)-3-ethenyl-2,2-diethyl-6-phenyloxasilinan-4-yl]oxy-trimethylsilane is sourced from PubChem (CID 11428026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).