tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane

C17H34O2Si2 — CID 11370827

IUPACtert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane
SMILESC=C(O[Si](C)(C)C)C1=C[C@@H](O[Si](C)(C)C(C)(C)C)CCC1
InChIInChI=1S/C17H34O2Si2/c1-14(18-20(5,6)7)15-11-10-12-16(13-15)19-21(8,9)17(2,3)4/h13,16H,1,10-12H2,2-9H3/t16-/m0/s1
InChIKeySFUWAILXZLEYCA-INIZCTEOSA-N
MW326.63 g/mol
LogP5.85
Rot. Bonds5

About tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane

tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane (PubChem CID 11370827) has the molecular formula C17H34O2Si2 and a molecular weight of 326.63 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane
PubChem CID11370827
Molecular FormulaC17H34O2Si2
Molecular Weight326.63 g/mol
Exact Mass326.21
IUPAC Nametert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane
SMILESC=C(O[Si](C)(C)C)C1=C[C@@H](O[Si](C)(C)C(C)(C)C)CCC1
InChIInChI=1S/C17H34O2Si2/c1-14(18-20(5,6)7)15-11-10-12-16(13-15)19-21(8,9)17(2,3)4/h13,16H,1,10-12H2,2-9H3/t16-/m0/s1
InChIKeySFUWAILXZLEYCA-INIZCTEOSA-N
XLogP5.85
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.63
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

Silane, [[1-(1-cyclohexen-1-yl)ethenyl]oxy](1,1-dimethylethyl)dimethyl-
CID 10955633
tert-Butyl-((S)-3-isopropenyl-cyclopent-2-enyloxy)-dimethyl-silane
CID 57386254
Silane, dimethyl(trans-3,7-dimethyl-2,6-octadien-1-yloxy)heptyloxy-
CID 91697247
Silane, dimethyl(trans-3,7-dimethyl-2,6-octadien-1-yloxy)octyloxy-
CID 91697248
Silane, dimethyl(trans-3,7-dimethyl-2,6-octadien-1-yloxy)nonyloxy-
CID 91710972
Silane, dimethyl(trans-3,7-dimethyl-2,6-octadien-1-yloxy)undecyloxy-
CID 91710973
Silane, dimethyl(trans-3,7-dimethyl-2,6-octadien-1-yloxy)dodecyloxy-
CID 91710974
Agn-PC-0ndtpk
CID 10977517
tert-butyl-[(2E)-2-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilyloxycyclopenten-1-yl]penta-2,4-dienoxy]-dimethylsilane
CID 11038372
tert-butyl-[3-[(2E)-1-[tert-butyl(dimethyl)silyl]oxypenta-2,4-dien-2-yl]-4-trimethylsilyloxycyclohex-2-en-1-yl]oxy-dimethylsilane
CID 11113802
tert-butyl-dimethyl-[(1R)-4-methylidenecyclohex-2-en-1-yl]oxysilane
CID 11401850
tert-butyl-[(1S,2R)-2-[tert-butyl(dimethyl)silyl]oxy-3-ethenylcyclohept-3-en-1-yl]oxy-dimethylsilane
CID 12162138

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane (CID 11370827) is tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane is C=C(O[Si](C)(C)C)C1=C[C@@H](O[Si](C)(C)C(C)(C)C)CCC1.
What is the InChIKey of tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane?
The InChIKey is SFUWAILXZLEYCA-INIZCTEOSA-N. The full InChI is InChI=1S/C17H34O2Si2/c1-14(18-20(5,6)7)15-11-10-12-16(13-15)19-21(8,9)17(2,3)4/h13,16H,1,10-12H2,2-9H3/t16-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane?
tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane has a molecular weight of 326.63 g/mol, XLogP of 5.85, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(1S)-3-(1-trimethylsilyloxyethenyl)cyclohex-2-en-1-yl]oxysilane is sourced from PubChem (CID 11370827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).