trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane

C10H18O2Si — CID 12771787

IUPACtrimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane
SMILESCC12CCC=C(O[Si](C)(C)C)C1O2
InChIInChI=1S/C10H18O2Si/c1-10-7-5-6-8(9(10)11-10)12-13(2,3)4/h6,9H,5,7H2,1-4H3
InChIKeyCQCFPIIXARNTTA-UHFFFAOYSA-N
MW198.34 g/mol
LogP2.67
Rot. Bonds2

About trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane

trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane (PubChem CID 12771787) has the molecular formula C10H18O2Si and a molecular weight of 198.34 g/mol. Its IUPAC name is trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane.

Molecular Properties

Compound Nametrimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane
PubChem CID12771787
Molecular FormulaC10H18O2Si
Molecular Weight198.34 g/mol
Exact Mass198.11
IUPAC Nametrimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane
SMILESCC12CCC=C(O[Si](C)(C)C)C1O2
InChIInChI=1S/C10H18O2Si/c1-10-7-5-6-8(9(10)11-10)12-13(2,3)4/h6,9H,5,7H2,1-4H3
InChIKeyCQCFPIIXARNTTA-UHFFFAOYSA-N
XLogP2.67
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.34
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(5-ethenyl-5-methyl-6-trimethylsilyloxycyclohexen-1-yl)oxy-trimethylsilane
CID 56958101
(5-chlorocyclopenten-1-yl)oxy-trimethylsilane
CID 12913653
(1S,5S)-5-methyl-6-oxabicyclo[3.1.0]hexan-2-one
CID 12628084
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]oxy-trimethylsilane
CID 124783835
(1R,5S)-6,6-dimethylbicyclo[3.1.1]heptan-2-one;[(1R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]oxy-trimethylsilane
CID 158558064
2,2-dimethyl-1-(2-trimethylsilyloxycyclohex-2-en-1-yl)propan-1-one
CID 101026385
(3S,5R,8Z)-12,15-dihydroxy-13-methoxy-5,9-dimethyl-4-oxatricyclo[9.4.0.03,5]pentadeca-1(11),8,12,14-tetraen-2-one
CID 139041129
(1S,3R,6S)-6-methyl-3-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptan-2-one
CID 130765296
(4Z)-1,5,9-trimethyl-13-oxabicyclo[10.1.0]trideca-4,8-diene
CID 139596542
(1R,4Z,8Z,12S)-1,5,9-trimethyl-13-oxabicyclo[10.1.0]trideca-4,8-diene
CID 93481800
(3S,5R,8E,12R,13R,14S)-14-hydroxy-5,9,12,13-tetramethyl-16-methylidene-4-oxatricyclo[10.3.1.03,5]hexadeca-1(15),8-dien-2-one
CID 95224745
(3S,5R,8E,12R,13S,14S)-14-hydroxy-5,9,12,13-tetramethyl-16-methylidene-4-oxatricyclo[10.3.1.03,5]hexadeca-1(15),8-dien-2-one
CID 95224744

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane?
The IUPAC name of trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane (CID 12771787) is trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane.
What is the SMILES notation for trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane?
The canonical SMILES for trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane is CC12CCC=C(O[Si](C)(C)C)C1O2.
What is the InChIKey of trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane?
The InChIKey is CQCFPIIXARNTTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2Si/c1-10-7-5-6-8(9(10)11-10)12-13(2,3)4/h6,9H,5,7H2,1-4H3.
What are the key properties of trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane?
trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane has a molecular weight of 198.34 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl)oxy]silane is sourced from PubChem (CID 12771787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).