trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane

C10H18O2Si — CID 134889954

IUPACtrimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
SMILESC[C@]12CCC=C(O[Si](C)(C)C)[C@H]1O2
InChIInChI=1S/C10H18O2Si/c1-10-7-5-6-8(9(10)11-10)12-13(2,3)4/h6,9H,5,7H2,1-4H3/t9-,10+/m1/s1
InChIKeyCQCFPIIXARNTTA-ZJUUUORDSA-N
MW198.34 g/mol
LogP2.67
Rot. Bonds2

About trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane

trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane (PubChem CID 134889954) has the molecular formula C10H18O2Si and a molecular weight of 198.34 g/mol. Its IUPAC name is trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane.

Molecular Properties

Compound Nametrimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
PubChem CID134889954
Molecular FormulaC10H18O2Si
Molecular Weight198.34 g/mol
Exact Mass198.11
IUPAC Nametrimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
SMILESC[C@]12CCC=C(O[Si](C)(C)C)[C@H]1O2
InChIInChI=1S/C10H18O2Si/c1-10-7-5-6-8(9(10)11-10)12-13(2,3)4/h6,9H,5,7H2,1-4H3/t9-,10+/m1/s1
InChIKeyCQCFPIIXARNTTA-ZJUUUORDSA-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

trimethyl-[[(1S,5R)-7-methylidene-6-oxabicyclo[3.2.1]oct-3-en-1-yl]oxy]silane
CID 134832645
trimethyl-[[(1R,4S,6R)-1-methyl-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
CID 11644380
Trimethyl-[[3-methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methoxy]silane
CID 13074681
trimethyl-[[(1S,4R,6S)-1-methyl-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
CID 46839064
trimethyl-[[(1S,6S)-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
CID 134889932
lithium (1R,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-olate
CID 134890094
trimethyl-[[(1R,4S,6R)-4-prop-1-en-2-yl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
CID 134939463
Lithium 6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-olate
CID 135045984
trimethyl-[[(1S,5R,6S)-5-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane
CID 135046184
triethyl-[[(1S,4R,5S)-4-methyl-6-oxabicyclo[3.1.0]hex-2-en-2-yl]oxy]silane
CID 139263633
[(1S,4R,5S)-4-butyl-6-oxabicyclo[3.1.0]hex-2-en-2-yl]oxy-triethylsilane
CID 139263634
[(1S,4S,5S)-4-tert-butyl-6-oxabicyclo[3.1.0]hex-2-en-2-yl]oxy-triethylsilane
CID 139263635

Frequently Asked Questions

What is the IUPAC name of trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane?
The IUPAC name of trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane (CID 134889954) is trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane.
What is the SMILES notation for trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane?
The canonical SMILES for trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane is C[C@]12CCC=C(O[Si](C)(C)C)[C@H]1O2.
What is the InChIKey of trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane?
The InChIKey is CQCFPIIXARNTTA-ZJUUUORDSA-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/t9-,10+/m1/s1.
What are the key properties of trimethyl-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane?
trimethyl-[[(1S,6S)-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-[[(1S,6S)-6-methyl-7-oxabicyclo[4.1.0]hept-2-en-2-yl]oxy]silane is sourced from PubChem (CID 134889954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).