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

C15H32O4Si — CID 12509412

IUPAC1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane
SMILESCCC(OOC(C)(C)C1CCCCC1)OO[Si](C)(C)C
InChIInChI=1S/C15H32O4Si/c1-7-14(17-19-20(4,5)6)16-18-15(2,3)13-11-9-8-10-12-13/h13-14H,7-12H2,1-6H3
InChIKeyAPYQXRHWCCDHIA-UHFFFAOYSA-N
MW304.50 g/mol
LogP4.81
Rot. Bonds8

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

1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane (PubChem CID 12509412) has the molecular formula C15H32O4Si and a molecular weight of 304.50 g/mol. Its IUPAC name is 1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane.

Molecular Properties

Compound Name1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane
PubChem CID12509412
Molecular FormulaC15H32O4Si
Molecular Weight304.50 g/mol
Exact Mass304.21
IUPAC Name1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane
SMILESCCC(OOC(C)(C)C1CCCCC1)OO[Si](C)(C)C
InChIInChI=1S/C15H32O4Si/c1-7-14(17-19-20(4,5)6)16-18-15(2,3)13-11-9-8-10-12-13/h13-14H,7-12H2,1-6H3
InChIKeyAPYQXRHWCCDHIA-UHFFFAOYSA-N
XLogP4.81
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.50
LogP ≤ 54.81
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)propylperoxy-trimethylsilane?
The IUPAC name of 1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane (CID 12509412) is 1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane.
What is the SMILES notation for 1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane?
The canonical SMILES for 1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane is CCC(OOC(C)(C)C1CCCCC1)OO[Si](C)(C)C.
What is the InChIKey of 1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane?
The InChIKey is APYQXRHWCCDHIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O4Si/c1-7-14(17-19-20(4,5)6)16-18-15(2,3)13-11-9-8-10-12-13/h13-14H,7-12H2,1-6H3.
What are the key properties of 1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane?
1-(2-cyclohexylpropan-2-ylperoxy)propylperoxy-trimethylsilane has a molecular weight of 304.50 g/mol, XLogP of 4.81, 8 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)propylperoxy-trimethylsilane is sourced from PubChem (CID 12509412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).