triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane

C22H44OSi2 — CID 135020841

IUPACtriethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane
SMILESC=CC/C(=C\C(CC(=C)C)O[Si](CC)(CC)CC)[Si](CC)(CC)CC
InChIInChI=1S/C22H44OSi2/c1-10-17-22(24(11-2,12-3)13-4)19-21(18-20(8)9)23-25(14-5,15-6)16-7/h10,19,21H,1,8,11-18H2,2-7,9H3/b22-19+
InChIKeyQIHGMTXJVSLXQW-ZBJSNUHESA-N
MW380.77 g/mol
LogP7.89
Rot. Bonds14

About triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane

triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane (PubChem CID 135020841) has the molecular formula C22H44OSi2 and a molecular weight of 380.77 g/mol. Its IUPAC name is triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane.

Molecular Properties

Compound Nametriethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane
PubChem CID135020841
Molecular FormulaC22H44OSi2
Molecular Weight380.77 g/mol
Exact Mass380.29
IUPAC Nametriethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane
SMILESC=CC/C(=C\C(CC(=C)C)O[Si](CC)(CC)CC)[Si](CC)(CC)CC
InChIInChI=1S/C22H44OSi2/c1-10-17-22(24(11-2,12-3)13-4)19-21(18-20(8)9)23-25(14-5,15-6)16-7/h10,19,21H,1,8,11-18H2,2-7,9H3/b22-19+
InChIKeyQIHGMTXJVSLXQW-ZBJSNUHESA-N
XLogP7.89
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.77
LogP ≤ 57.89
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

Geraniol, tert-butyldimethylsilyl ether
CID 6536899
(2-Cyclopenten-1-yloxy)(triisopropyl)silane
CID 10977584
Farnesol, tert-butyldimethylsilyl ether
CID 10337114
Tert-butyl-cyclopent-2-en-1-yloxy-dimethylsilane
CID 9815574
Ctk0J4668
CID 11106001
[(2E,5E)-3,5-dimethylhepta-2,5-dien-4-yl]oxy-dimethyl-prop-2-enylsilane
CID 11543224
tert-butyl-[(1S)-cyclopent-2-en-1-yl]oxy-dimethylsilane
CID 12445093
tert-butyl-[(1S,4R)-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-yl]oxy-dimethylsilane
CID 15110385
6-[(E)-but-2-en-2-yl]-2,2,5-trimethyl-3,6-dihydrooxasiline
CID 135063549
tert-butyl-[(2E,6E)-5-[tert-butyl(dimethyl)silyl]oxy-2-methylocta-2,6-dienoxy]-dimethylsilane
CID 5387042
2-Triisobutylsilyloxyoct-3-ene
CID 5353180
2-Tripropylsilyloxyoct-3-ene
CID 5353192

Frequently Asked Questions

What is the IUPAC name of triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane?
The IUPAC name of triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane (CID 135020841) is triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane.
What is the SMILES notation for triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane?
The canonical SMILES for triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane is C=CC/C(=C\C(CC(=C)C)O[Si](CC)(CC)CC)[Si](CC)(CC)CC.
What is the InChIKey of triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane?
The InChIKey is QIHGMTXJVSLXQW-ZBJSNUHESA-N. The full InChI is InChI=1S/C22H44OSi2/c1-10-17-22(24(11-2,12-3)13-4)19-21(18-20(8)9)23-25(14-5,15-6)16-7/h10,19,21H,1,8,11-18H2,2-7,9H3/b22-19+.
What are the key properties of triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane?
triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane has a molecular weight of 380.77 g/mol, XLogP of 7.89, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(2E)-1-(2-methylprop-2-enyl)-3-triethylsilylhexa-2,5-dienoxy]silane is sourced from PubChem (CID 135020841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).