3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate

C15H30O6Si — CID 171586980

IUPAC3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCCOCCCOCC[Si](C)(OC)OC
InChIInChI=1S/C15H30O6Si/c1-14(2)15(16)21-11-7-10-19-8-6-9-20-12-13-22(5,17-3)18-4/h1,6-13H2,2-5H3
InChIKeyVKOCEFQYHJSLAU-UHFFFAOYSA-N
MW334.49 g/mol
LogP2.28
Rot. Bonds14

About 3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate

3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate (PubChem CID 171586980) has the molecular formula C15H30O6Si and a molecular weight of 334.49 g/mol. Its IUPAC name is 3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate
PubChem CID171586980
Molecular FormulaC15H30O6Si
Molecular Weight334.49 g/mol
Exact Mass334.18
IUPAC Name3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCCOCCCOCC[Si](C)(OC)OC
InChIInChI=1S/C15H30O6Si/c1-14(2)15(16)21-11-7-10-19-8-6-9-20-12-13-22(5,17-3)18-4/h1,6-13H2,2-5H3
InChIKeyVKOCEFQYHJSLAU-UHFFFAOYSA-N
XLogP2.28
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.49
LogP ≤ 52.28
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'}

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Related Compounds

3-[2-[dimethoxy(methyl)silyl]ethoxy]propyl 2-methylprop-2-enoate
CID 171586989
2-[dimethoxy(methyl)silyl]ethoxymethyl 2-methylprop-2-enoate
CID 171586969
3-[2-[3-(2-methylprop-2-enoyloxy)propoxy]ethoxy]propyl 2-methylprop-2-enoate
CID 87490108
3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
CID 87862843
4-[4-[4-(2-methylprop-2-enoyloxy)butoxy]butoxy]butyl 2-methylprop-2-enoate
CID 101360150
3-[3-[3-[2-(2-methoxyethoxy)ethoxy]propyl-dimethylsilyl]propyl-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 139645621
3-(hydroxy-methoxy-methylsilyl)propyl 2-methylprop-2-enoate
CID 140965642
azane;3-trimethoxysilylpropyl 2-methylprop-2-enoate
CID 174919252
3-[3-[dimethyl(propoxy)silyl]propoxy]propyl 2-methylprop-2-enoate
CID 139816501
11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate
CID 142567351
3-[methyl-bis(methylperoxy)silyl]propyl 2-methylprop-2-enoate
CID 141453327
10-[methoxy(dimethyl)silyl]decyl 2-methylprop-2-enoate
CID 142567352

Frequently Asked Questions

What is the IUPAC name of 3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate?
The IUPAC name of 3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate (CID 171586980) is 3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate.
What is the SMILES notation for 3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate?
The canonical SMILES for 3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCCOCCCOCC[Si](C)(OC)OC.
What is the InChIKey of 3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate?
The InChIKey is VKOCEFQYHJSLAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O6Si/c1-14(2)15(16)21-11-7-10-19-8-6-9-20-12-13-22(5,17-3)18-4/h1,6-13H2,2-5H3.
What are the key properties of 3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate?
3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate has a molecular weight of 334.49 g/mol, XLogP of 2.28, 14 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[2-[dimethoxy(methyl)silyl]ethoxy]propoxy]propyl 2-methylprop-2-enoate is sourced from PubChem (CID 171586980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).