[3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane

C17H30OSi — CID 10826486

IUPAC[3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC1=CC(CCC2=CCCCC2)CCC1
InChIInChI=1S/C17H30OSi/c1-19(2,3)18-17-11-7-10-16(14-17)13-12-15-8-5-4-6-9-15/h8,14,16H,4-7,9-13H2,1-3H3
InChIKeyBCSXCTUSQBFBJN-UHFFFAOYSA-N
MW278.51 g/mol
LogP5.80
Rot. Bonds5

About [3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane

[3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane (PubChem CID 10826486) has the molecular formula C17H30OSi and a molecular weight of 278.51 g/mol. Its IUPAC name is [3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane
PubChem CID10826486
Molecular FormulaC17H30OSi
Molecular Weight278.51 g/mol
Exact Mass278.21
IUPAC Name[3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC1=CC(CCC2=CCCCC2)CCC1
InChIInChI=1S/C17H30OSi/c1-19(2,3)18-17-11-7-10-16(14-17)13-12-15-8-5-4-6-9-15/h8,14,16H,4-7,9-13H2,1-3H3
InChIKeyBCSXCTUSQBFBJN-UHFFFAOYSA-N
XLogP5.80
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.51
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

(3-Ethylcyclohexen-1-yl)oxy-trimethylsilane
CID 597987
Trimethyl-[3-(3-methylbut-3-enyl)cyclohexen-1-yl]oxysilane
CID 10490148
Trimethyl-[3-(4-methylpent-3-enyl)cyclohexen-1-yl]oxysilane
CID 10658496
(3-But-3-enylcyclohexen-1-yl)oxy-trimethylsilane
CID 11042390
trimethyl-[(3R,6S)-3-methyl-6-propan-2-ylcyclohexen-1-yl]oxysilane
CID 11096320
[(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane
CID 11229389
[3-[2-(Cyclohexen-1-yl)ethyl]-3-methylcyclopenten-1-yl]oxy-trimethylsilane
CID 21593729
tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane
CID 162400600
(2-Fluoro-4-hex-1-en-2-ylcyclohexen-1-yl)oxy-trimethylsilane
CID 123304026
alpha-Bisabolol, TMS derivative
CID 14486055
Trimethyl-(3-methylcyclopentadecen-1-yl)oxysilane
CID 69502889
[(1E,3S,7R)-3,7-dimethylcycloocten-1-yl]oxy-trimethylsilane
CID 10585376

Frequently Asked Questions

What is the IUPAC name of [3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane?
The IUPAC name of [3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane (CID 10826486) is [3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane.
What is the SMILES notation for [3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane?
The canonical SMILES for [3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane is C[Si](C)(C)OC1=CC(CCC2=CCCCC2)CCC1.
What is the InChIKey of [3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane?
The InChIKey is BCSXCTUSQBFBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30OSi/c1-19(2,3)18-17-11-7-10-16(14-17)13-12-15-8-5-4-6-9-15/h8,14,16H,4-7,9-13H2,1-3H3.
What are the key properties of [3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane?
[3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane has a molecular weight of 278.51 g/mol, XLogP of 5.80, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2-(cyclohexen-1-yl)ethyl]cyclohexen-1-yl]oxy-trimethylsilane is sourced from PubChem (CID 10826486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).