trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane

C18H32O2Si2 — CID 12066571

IUPACtrimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane
SMILESC=CC[C@](O[Si](C)(C)C)(c1ccccc1)[C@@H](C)O[Si](C)(C)C
InChIInChI=1S/C18H32O2Si2/c1-9-15-18(20-22(6,7)8,16(2)19-21(3,4)5)17-13-11-10-12-14-17/h9-14,16H,1,15H2,2-8H3/t16-,18-/m1/s1
InChIKeyVZCCRWUWPSUGND-SJLPKXTDSA-N
MW336.62 g/mol
LogP5.55
Rot. Bonds8

About trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane

trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane (PubChem CID 12066571) has the molecular formula C18H32O2Si2 and a molecular weight of 336.62 g/mol. Its IUPAC name is trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane
PubChem CID12066571
Molecular FormulaC18H32O2Si2
Molecular Weight336.62 g/mol
Exact Mass336.19
IUPAC Nametrimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane
SMILESC=CC[C@](O[Si](C)(C)C)(c1ccccc1)[C@@H](C)O[Si](C)(C)C
InChIInChI=1S/C18H32O2Si2/c1-9-15-18(20-22(6,7)8,16(2)19-21(3,4)5)17-13-11-10-12-14-17/h9-14,16H,1,15H2,2-8H3/t16-,18-/m1/s1
InChIKeyVZCCRWUWPSUGND-SJLPKXTDSA-N
XLogP5.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.62
LogP ≤ 55.55
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

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trimethyl(trityloxy)silane
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4-propylhept-1-en-4-ylbenzene
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(2S)-2-methyl-2-phenylpent-4-enal
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[(2R)-2-prop-2-enoxypent-4-en-2-yl]benzene
CID 100966368
[(2S)-2-prop-2-enoxypent-4-en-2-yl]benzene
CID 100966369
(1-methoxy-1-phenylbut-3-enyl)benzene;hydrate
CID 67237772
3-nitro-2-phenyl-2-trimethylsilyloxybutanenitrile
CID 11208204
(2,3-diphenyl-3-trimethylsilyloxybutan-2-yl)oxy-trimethylsilane
CID 10068766
3-phenylhex-5-ene-2,3-diol;phosphorous acid
CID 67770210
trimethyl-[(S)-phenyl-[(1S)-1-phenylbut-3-enoxy]methyl]silane
CID 15532498

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane?
The IUPAC name of trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane (CID 12066571) is trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane.
What is the SMILES notation for trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane?
The canonical SMILES for trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane is C=CC[C@](O[Si](C)(C)C)(c1ccccc1)[C@@H](C)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane?
The InChIKey is VZCCRWUWPSUGND-SJLPKXTDSA-N. The full InChI is InChI=1S/C18H32O2Si2/c1-9-15-18(20-22(6,7)8,16(2)19-21(3,4)5)17-13-11-10-12-14-17/h9-14,16H,1,15H2,2-8H3/t16-,18-/m1/s1.
What are the key properties of trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane?
trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane has a molecular weight of 336.62 g/mol, XLogP of 5.55, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(2R,3S)-3-phenyl-2-trimethylsilyloxyhex-5-en-3-yl]oxysilane is sourced from PubChem (CID 12066571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).