1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane

C14H30O4Si — CID 12509409

IUPAC1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane
SMILESCC(OOC(C)(C)C1CCCCC1)OO[Si](C)(C)C
InChIInChI=1S/C14H30O4Si/c1-12(16-18-19(4,5)6)15-17-14(2,3)13-10-8-7-9-11-13/h12-13H,7-11H2,1-6H3
InChIKeyWHMLDAVJUPBLDC-UHFFFAOYSA-N
MW290.48 g/mol
LogP4.42
Rot. Bonds7

About 1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane

1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane (PubChem CID 12509409) has the molecular formula C14H30O4Si and a molecular weight of 290.48 g/mol. Its IUPAC name is 1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane.

Molecular Properties

Compound Name1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane
PubChem CID12509409
Molecular FormulaC14H30O4Si
Molecular Weight290.48 g/mol
Exact Mass290.19
IUPAC Name1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane
SMILESCC(OOC(C)(C)C1CCCCC1)OO[Si](C)(C)C
InChIInChI=1S/C14H30O4Si/c1-12(16-18-19(4,5)6)15-17-14(2,3)13-10-8-7-9-11-13/h12-13H,7-11H2,1-6H3
InChIKeyWHMLDAVJUPBLDC-UHFFFAOYSA-N
XLogP4.42
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.48
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane?
The IUPAC name of 1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane (CID 12509409) is 1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane.
What is the SMILES notation for 1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane?
The canonical SMILES for 1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane is CC(OOC(C)(C)C1CCCCC1)OO[Si](C)(C)C.
What is the InChIKey of 1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane?
The InChIKey is WHMLDAVJUPBLDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O4Si/c1-12(16-18-19(4,5)6)15-17-14(2,3)13-10-8-7-9-11-13/h12-13H,7-11H2,1-6H3.
What are the key properties of 1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane?
1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane has a molecular weight of 290.48 g/mol, XLogP of 4.42, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylpropan-2-ylperoxy)ethylperoxy-trimethylsilane is sourced from PubChem (CID 12509409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).