[(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane

C16H32O2Si2 — CID 5359143

IUPAC[(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane
SMILESC/C1=C(O[Si](C)(C)C)/C(O[Si](C)(C)C)=C(/C)CCCC1
InChIInChI=1S/C16H32O2Si2/c1-13-11-9-10-12-14(2)16(18-20(6,7)8)15(13)17-19(3,4)5/h9-12H2,1-8H3/b15-13+,16-14+
InChIKeyQULRFFFDPHPLPG-WXUKJITCSA-N
MW312.60 g/mol
LogP5.81
Rot. Bonds4

About [(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane

[(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane (PubChem CID 5359143) has the molecular formula C16H32O2Si2 and a molecular weight of 312.60 g/mol. Its IUPAC name is [(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane
PubChem CID5359143
Molecular FormulaC16H32O2Si2
Molecular Weight312.60 g/mol
Exact Mass312.19
IUPAC Name[(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane
SMILESC/C1=C(O[Si](C)(C)C)/C(O[Si](C)(C)C)=C(/C)CCCC1
InChIInChI=1S/C16H32O2Si2/c1-13-11-9-10-12-14(2)16(18-20(6,7)8)15(13)17-19(3,4)5/h9-12H2,1-8H3/b15-13+,16-14+
InChIKeyQULRFFFDPHPLPG-WXUKJITCSA-N
XLogP5.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.60
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane?
The IUPAC name of [(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane (CID 5359143) is [(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane.
What is the SMILES notation for [(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane?
The canonical SMILES for [(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane is C/C1=C(O[Si](C)(C)C)/C(O[Si](C)(C)C)=C(/C)CCCC1.
What is the InChIKey of [(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane?
The InChIKey is QULRFFFDPHPLPG-WXUKJITCSA-N. The full InChI is InChI=1S/C16H32O2Si2/c1-13-11-9-10-12-14(2)16(18-20(6,7)8)15(13)17-19(3,4)5/h9-12H2,1-8H3/b15-13+,16-14+.
What are the key properties of [(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane?
[(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane has a molecular weight of 312.60 g/mol, XLogP of 5.81, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1E,7E)-2,7-dimethyl-8-trimethylsilyloxycycloocta-1,7-dien-1-yl]oxy-trimethylsilane is sourced from PubChem (CID 5359143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).