[1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane

C17H30O2Si — CID 117069572

IUPAC[1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane
SMILESCC1CC2(CC(C)C1=CC1([Si](C)(C)C)CC1)OCCO2
InChIInChI=1S/C17H30O2Si/c1-13-10-17(18-8-9-19-17)11-14(2)15(13)12-16(6-7-16)20(3,4)5/h12-14H,6-11H2,1-5H3
InChIKeyOSWRMIOOUYBUEL-UHFFFAOYSA-N
MW294.51 g/mol
LogP4.59
Rot. Bonds2

About [1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane

[1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane (PubChem CID 117069572) has the molecular formula C17H30O2Si and a molecular weight of 294.51 g/mol. Its IUPAC name is [1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane.

Molecular Properties

Compound Name[1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane
PubChem CID117069572
Molecular FormulaC17H30O2Si
Molecular Weight294.51 g/mol
Exact Mass294.20
IUPAC Name[1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane
SMILESCC1CC2(CC(C)C1=CC1([Si](C)(C)C)CC1)OCCO2
InChIInChI=1S/C17H30O2Si/c1-13-10-17(18-8-9-19-17)11-14(2)15(13)12-16(6-7-16)20(3,4)5/h12-14H,6-11H2,1-5H3
InChIKeyOSWRMIOOUYBUEL-UHFFFAOYSA-N
XLogP4.59
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.51
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane?
The IUPAC name of [1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane (CID 117069572) is [1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane.
What is the SMILES notation for [1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane?
The canonical SMILES for [1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane is CC1CC2(CC(C)C1=CC1([Si](C)(C)C)CC1)OCCO2.
What is the InChIKey of [1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane?
The InChIKey is OSWRMIOOUYBUEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30O2Si/c1-13-10-17(18-8-9-19-17)11-14(2)15(13)12-16(6-7-16)20(3,4)5/h12-14H,6-11H2,1-5H3.
What are the key properties of [1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane?
[1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane has a molecular weight of 294.51 g/mol, XLogP of 4.59, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(7,9-dimethyl-1,4-dioxaspiro[4.5]decan-8-ylidene)methyl]cyclopropyl]-trimethylsilane is sourced from PubChem (CID 117069572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).