trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane

C16H22OSi — CID 101177918

IUPACtrimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane
SMILESC[Si](C)(C)/C=C1\CCC2OC1Cc1ccccc12
InChIInChI=1S/C16H22OSi/c1-18(2,3)11-13-8-9-15-14-7-5-4-6-12(14)10-16(13)17-15/h4-7,11,15-16H,8-10H2,1-3H3/b13-11+
InChIKeyXPMDZFYZIKGEPZ-ACCUITESSA-N
MW258.44 g/mol
LogP4.27
Rot. Bonds1

About trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane

trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane (PubChem CID 101177918) has the molecular formula C16H22OSi and a molecular weight of 258.44 g/mol. Its IUPAC name is trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane.

Molecular Properties

Compound Nametrimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane
PubChem CID101177918
Molecular FormulaC16H22OSi
Molecular Weight258.44 g/mol
Exact Mass258.14
IUPAC Nametrimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane
SMILESC[Si](C)(C)/C=C1\CCC2OC1Cc1ccccc12
InChIInChI=1S/C16H22OSi/c1-18(2,3)11-13-8-9-15-14-7-5-4-6-12(14)10-16(13)17-15/h4-7,11,15-16H,8-10H2,1-3H3/b13-11+
InChIKeyXPMDZFYZIKGEPZ-ACCUITESSA-N
XLogP4.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.44
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane with MolForge

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Related Compounds

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CID 139054065
tert-butyl-[(E)-[(1S,8R)-13-oxatricyclo[6.4.1.02,7]trideca-2,4,6-trien-10-ylidene]methoxy]-diphenylsilane
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(1R,9R)-3-methoxy-5-[(E)-prop-1-enyl]-17-oxatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4,6,10,12,14-hexaen-6-ol
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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane?
The IUPAC name of trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane (CID 101177918) is trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane.
What is the SMILES notation for trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane?
The canonical SMILES for trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane is C[Si](C)(C)/C=C1\CCC2OC1Cc1ccccc12.
What is the InChIKey of trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane?
The InChIKey is XPMDZFYZIKGEPZ-ACCUITESSA-N. The full InChI is InChI=1S/C16H22OSi/c1-18(2,3)11-13-8-9-15-14-7-5-4-6-12(14)10-16(13)17-15/h4-7,11,15-16H,8-10H2,1-3H3/b13-11+.
What are the key properties of trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane?
trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane has a molecular weight of 258.44 g/mol, XLogP of 4.27, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-13-oxatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-ylidenemethyl]silane is sourced from PubChem (CID 101177918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).