3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate

C10H20O6Si — CID 141453327

IUPAC3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](C)(OOC)OOC
InChIInChI=1S/C10H20O6Si/c1-9(2)10(11)14-7-6-8-17(5,15-12-3)16-13-4/h1,6-8H2,2-5H3
InChIKeyVQXVNGZZFRVNLY-UHFFFAOYSA-N
MW264.35 g/mol
LogP1.72
Rot. Bonds9

About 3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate

3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate (PubChem CID 141453327) has the molecular formula C10H20O6Si and a molecular weight of 264.35 g/mol. Its IUPAC name is 3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate
PubChem CID141453327
Molecular FormulaC10H20O6Si
Molecular Weight264.35 g/mol
Exact Mass264.10
IUPAC Name3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](C)(OOC)OOC
InChIInChI=1S/C10H20O6Si/c1-9(2)10(11)14-7-6-8-17(5,15-12-3)16-13-4/h1,6-8H2,2-5H3
InChIKeyVQXVNGZZFRVNLY-UHFFFAOYSA-N
XLogP1.72
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', '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 3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate?
The IUPAC name of 3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate (CID 141453327) is 3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate.
What is the SMILES notation for 3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate?
The canonical SMILES for 3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCC[Si](C)(OOC)OOC.
What is the InChIKey of 3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate?
The InChIKey is VQXVNGZZFRVNLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O6Si/c1-9(2)10(11)14-7-6-8-17(5,15-12-3)16-13-4/h1,6-8H2,2-5H3.
What are the key properties of 3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate?
3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate has a molecular weight of 264.35 g/mol, XLogP of 1.72, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate is sourced from PubChem (CID 141453327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).