7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one

C15H24OSi2 — CID 85424284

IUPAC7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one
SMILESC[Si](C)(C)C12C(=O)C3([Si](C)(C)C)C4C=CC1C2C43
InChIInChI=1S/C15H24OSi2/c1-17(2,3)14-9-7-8-10-12(11(9)14)15(10,13(14)16)18(4,5)6/h7-12H,1-6H3
InChIKeyFIZQZDULLBAPHI-UHFFFAOYSA-N
MW276.53 g/mol
LogP3.79
Rot. Bonds2

About 7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one

7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one (PubChem CID 85424284) has the molecular formula C15H24OSi2 and a molecular weight of 276.53 g/mol. Its IUPAC name is 7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one.

Molecular Properties

Compound Name7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one
PubChem CID85424284
Molecular FormulaC15H24OSi2
Molecular Weight276.53 g/mol
Exact Mass276.14
IUPAC Name7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one
SMILESC[Si](C)(C)C12C(=O)C3([Si](C)(C)C)C4C=CC1C2C43
InChIInChI=1S/C15H24OSi2/c1-17(2,3)14-9-7-8-10-12(11(9)14)15(10,13(14)16)18(4,5)6/h7-12H,1-6H3
InChIKeyFIZQZDULLBAPHI-UHFFFAOYSA-N
XLogP3.79
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.53
LogP ≤ 53.79
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

(1S,3R,4S,6S,7R,8S,9S,10R,13S,16R)-octacyclo[8.6.0.01,6.03,9.04,8.06,13.07,11.012,16]hexadec-14-ene-2,5-dione
CID 98556936
(6R,9S,10R,11R,12S,15R)-4-methylhexacyclo[7.6.0.01,5.05,12.06,10.011,15]pentadeca-3,7,13-trien-2-one
CID 98556963
10-butyl-10-hydroxytricyclo[4.2.1.12,5]deca-3,7-dien-9-one
CID 570790
(1R,2R,7S,8S)-3,3,10,10-tetramethoxytricyclo[6.2.2.02,7]dodeca-5,11-diene-4,9-dione
CID 101401921
4-methylspiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-3,5-dione
CID 4534981
(3aR,6aS)-3,3a,4,6a-tetrahydrocyclopenta[b]furan-2-one
CID 11400761
methyl (1S,2S,7R,8R)-6,6,12,12-tetramethoxy-5,11-dioxotricyclo[6.2.2.02,7]dodeca-3,9-diene-3-carboxylate
CID 101401913
cyclopenta-2,4-dien-1-ylselanyl(trimethyl)silane
CID 102206865
(1'R,2'R,5'S,6'S)-8'-tri(propan-2-yl)silyloxyspiro[cyclopropane-1,11'-tricyclo[4.3.1.12,5]undec-3-ene]-10'-one
CID 146020448
(1R,2R,6R,7R)-8,8-dimethoxy-3-oxatricyclo[5.2.2.02,6]undec-10-en-9-one
CID 101086298
15-oxaoctacyclo[10.5.2.12,8.02,11.03,7.04,11.05,9.013,17]icos-18-ene-10,14,16,20-tetrone
CID 15921750
(1S,2S,3S,4R,5R,7S,8R,9S,11R,12R,13R,15S)-octacyclo[10.3.2.12,8.02,11.03,7.04,11.05,9.013,15]octadec-16-ene-10,18-dione
CID 101237452

Frequently Asked Questions

What is the IUPAC name of 7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one?
The IUPAC name of 7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one (CID 85424284) is 7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one.
What is the SMILES notation for 7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one?
The canonical SMILES for 7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one is C[Si](C)(C)C12C(=O)C3([Si](C)(C)C)C4C=CC1C2C43.
What is the InChIKey of 7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one?
The InChIKey is FIZQZDULLBAPHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24OSi2/c1-17(2,3)14-9-7-8-10-12(11(9)14)15(10,13(14)16)18(4,5)6/h7-12H,1-6H3.
What are the key properties of 7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one?
7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one has a molecular weight of 276.53 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,9-bis(trimethylsilyl)tetracyclo[4.3.0.02,9.05,7]non-3-en-8-one is sourced from PubChem (CID 85424284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).