[dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate

C15H28O9Si2 — CID 90301898

IUPAC[dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate
SMILESC=CC(=O)OC(CC[Si](OC)(OC)OC)C(=C)C(=O)O[Si](C)(OC)OC
InChIInChI=1S/C15H28O9Si2/c1-9-14(16)23-13(10-11-26(20-5,21-6)22-7)12(2)15(17)24-25(8,18-3)19-4/h9,13H,1-2,10-11H2,3-8H3
InChIKeyUYKSBSGCXQZABP-UHFFFAOYSA-N
MW408.55 g/mol
LogP1.31
Rot. Bonds13

About [dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate

[dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate (PubChem CID 90301898) has the molecular formula C15H28O9Si2 and a molecular weight of 408.55 g/mol. Its IUPAC name is [dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate.

Molecular Properties

Compound Name[dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate
PubChem CID90301898
Molecular FormulaC15H28O9Si2
Molecular Weight408.55 g/mol
Exact Mass408.13
IUPAC Name[dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate
SMILESC=CC(=O)OC(CC[Si](OC)(OC)OC)C(=C)C(=O)O[Si](C)(OC)OC
InChIInChI=1S/C15H28O9Si2/c1-9-14(16)23-13(10-11-26(20-5,21-6)22-7)12(2)15(17)24-25(8,18-3)19-4/h9,13H,1-2,10-11H2,3-8H3
InChIKeyUYKSBSGCXQZABP-UHFFFAOYSA-N
XLogP1.31
TPSA98.75 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds13
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.55
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate?
The IUPAC name of [dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate (CID 90301898) is [dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate.
What is the SMILES notation for [dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate?
The canonical SMILES for [dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate is C=CC(=O)OC(CC[Si](OC)(OC)OC)C(=C)C(=O)O[Si](C)(OC)OC.
What is the InChIKey of [dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate?
The InChIKey is UYKSBSGCXQZABP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O9Si2/c1-9-14(16)23-13(10-11-26(20-5,21-6)22-7)12(2)15(17)24-25(8,18-3)19-4/h9,13H,1-2,10-11H2,3-8H3.
What are the key properties of [dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate?
[dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate has a molecular weight of 408.55 g/mol, XLogP of 1.31, 13 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethoxy(methyl)silyl] 2-methylidene-3-prop-2-enoyloxy-5-trimethoxysilylpentanoate is sourced from PubChem (CID 90301898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).