[5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane

C17H32OSi — CID 134996885

IUPAC[5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane
SMILESCC(C)=CCCC(C)CC1C=CC(C[Si](C)(C)C)O1
InChIInChI=1S/C17H32OSi/c1-14(2)8-7-9-15(3)12-16-10-11-17(18-16)13-19(4,5)6/h8,10-11,15-17H,7,9,12-13H2,1-6H3
InChIKeyUTDQQGPNYJGESA-UHFFFAOYSA-N
MW280.53 g/mol
LogP5.42
Rot. Bonds7

About [5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane

[5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane (PubChem CID 134996885) has the molecular formula C17H32OSi and a molecular weight of 280.53 g/mol. Its IUPAC name is [5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane.

Molecular Properties

Compound Name[5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane
PubChem CID134996885
Molecular FormulaC17H32OSi
Molecular Weight280.53 g/mol
Exact Mass280.22
IUPAC Name[5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane
SMILESCC(C)=CCCC(C)CC1C=CC(C[Si](C)(C)C)O1
InChIInChI=1S/C17H32OSi/c1-14(2)8-7-9-15(3)12-16-10-11-17(18-16)13-19(4,5)6/h8,10-11,15-17H,7,9,12-13H2,1-6H3
InChIKeyUTDQQGPNYJGESA-UHFFFAOYSA-N
XLogP5.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.53
LogP ≤ 55.42
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

[(1S,2R,4S,5R)-2,4-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-yl]oxy-tri(propan-2-yl)silane
CID 11370334
[(2S,5S)-5-cyclohexyl-2-ethenyl-2,5-dihydrofuran-3-yl]-trimethylsilane
CID 11736827
[2-(3,7-Dimethyloct-6-enoxymethyl)cyclopropen-1-yl]-trimethylsilane
CID 101516450
Tert-butyl-(4-decyl-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane
CID 134905111
trimethyl-[[5-[(E)-oct-5-enyl]-2,5-dihydrofuran-2-yl]methyl]silane
CID 134997144
Tert-butyl-(5-hexyl-3-methylcyclopent-2-en-1-yl)oxy-dimethylsilane
CID 135070894
[(3R)-2-butyl-3-[(E)-3-pentan-3-yloxyprop-1-enyl]cyclohexen-1-yl]oxy-triethylsilane
CID 176427863
tert-butyl-dimethyl-[(1R)-1-[(2S)-4-methyl-2,5-dihydrofuran-2-yl]hex-5-enoxy]silane
CID 10732731
tert-butyl-dimethyl-[(1S)-1-[(2S)-4-methyl-2,5-dihydrofuran-2-yl]hex-5-enoxy]silane
CID 10803913
Triethyl-[methoxy-(3-trimethylsilyl-2-bicyclo[2.2.1]hepta-2,5-dienyl)methyl]silane
CID 14922666
trimethyl-[(4S)-4-methyl-2-methylidene-5-[(2R,6R)-6-(3-trimethylsilylprop-2-ynyl)-3,6-dihydro-2H-pyran-2-yl]pentyl]silane
CID 11954549
8-Methyl-6-(8-methylundec-4-en-6-yloxy)undec-4-ene
CID 57150633

Frequently Asked Questions

What is the IUPAC name of [5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane?
The IUPAC name of [5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane (CID 134996885) is [5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane.
What is the SMILES notation for [5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane?
The canonical SMILES for [5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane is CC(C)=CCCC(C)CC1C=CC(C[Si](C)(C)C)O1.
What is the InChIKey of [5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane?
The InChIKey is UTDQQGPNYJGESA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32OSi/c1-14(2)8-7-9-15(3)12-16-10-11-17(18-16)13-19(4,5)6/h8,10-11,15-17H,7,9,12-13H2,1-6H3.
What are the key properties of [5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane?
[5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane has a molecular weight of 280.53 g/mol, XLogP of 5.42, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2,6-dimethylhept-5-enyl)-2,5-dihydrofuran-2-yl]methyl-trimethylsilane is sourced from PubChem (CID 134996885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).