2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate

C14H28O4Si — CID 139977821

IUPAC2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC[Si](CCCC)(OCC)OCC
InChIInChI=1S/C14H28O4Si/c1-6-9-11-19(17-7-2,18-8-3)12-10-16-14(15)13(4)5/h4,6-12H2,1-3,5H3
InChIKeyQOVIDZCJUOBOOJ-UHFFFAOYSA-N
MW288.46 g/mol
LogP3.42
Rot. Bonds11

About 2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate

2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate (PubChem CID 139977821) has the molecular formula C14H28O4Si and a molecular weight of 288.46 g/mol. Its IUPAC name is 2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate
PubChem CID139977821
Molecular FormulaC14H28O4Si
Molecular Weight288.46 g/mol
Exact Mass288.18
IUPAC Name2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC[Si](CCCC)(OCC)OCC
InChIInChI=1S/C14H28O4Si/c1-6-9-11-19(17-7-2,18-8-3)12-10-16-14(15)13(4)5/h4,6-12H2,1-3,5H3
InChIKeyQOVIDZCJUOBOOJ-UHFFFAOYSA-N
XLogP3.42
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[dibutoxy(ethyl)silyl]ethyl 2-methylprop-2-enoate
CID 21432018
5-[diethoxy(ethyl)silyl]pentyl 2-methylprop-2-enoate
CID 139712375
2-tributoxysilylethyl 2-methylprop-2-enoate
CID 21432006
[dibutyl(2-methylprop-2-enoyloxy)silyl] 2-methylprop-2-enoate
CID 153439669
4-[butoxy(diethoxy)silyl]butyl 2-methylprop-2-enoate
CID 139977875
butyl 2-methylprop-2-enoate;methane
CID 159646333
butyl 2-methylprop-2-enoate;λ2-stannane
CID 173448670
2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;tridecane
CID 87383190
butyl 2-methylprop-2-enoate;ethene
CID 158758814
3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 22094222
2-[bis[2-(2-methylprop-2-enoyloxy)ethoxy]-pentylsilyl]oxyethyl 2-methylprop-2-enoate
CID 101194851
5-[ethoxy(dipropyl)silyl]pentyl 2-methylprop-2-enoate
CID 140668073

Frequently Asked Questions

What is the IUPAC name of 2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate?
The IUPAC name of 2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate (CID 139977821) is 2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate.
What is the SMILES notation for 2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate?
The canonical SMILES for 2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate is C=C(C)C(=O)OCC[Si](CCCC)(OCC)OCC.
What is the InChIKey of 2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate?
The InChIKey is QOVIDZCJUOBOOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O4Si/c1-6-9-11-19(17-7-2,18-8-3)12-10-16-14(15)13(4)5/h4,6-12H2,1-3,5H3.
What are the key properties of 2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate?
2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate has a molecular weight of 288.46 g/mol, XLogP of 3.42, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl(diethoxy)silyl]ethyl 2-methylprop-2-enoate is sourced from PubChem (CID 139977821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).