(2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate

C14H28O5Si — CID 22597143

IUPAC(2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC(C)C[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H28O5Si/c1-7-17-20(18-8-2,19-9-3)11-13(6)10-16-14(15)12(4)5/h13H,4,7-11H2,1-3,5-6H3
InChIKeyABAAFUXTIYJPIP-UHFFFAOYSA-N
MW304.46 g/mol
LogP2.79
Rot. Bonds11

About (2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate

(2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate (PubChem CID 22597143) has the molecular formula C14H28O5Si and a molecular weight of 304.46 g/mol. Its IUPAC name is (2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate.

Molecular Properties

Compound Name(2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate
PubChem CID22597143
Molecular FormulaC14H28O5Si
Molecular Weight304.46 g/mol
Exact Mass304.17
IUPAC Name(2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC(C)C[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H28O5Si/c1-7-17-20(18-8-2,19-9-3)11-13(6)10-16-14(15)12(4)5/h13H,4,7-11H2,1-3,5-6H3
InChIKeyABAAFUXTIYJPIP-UHFFFAOYSA-N
XLogP2.79
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.46
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

ethyl 2-methylprop-2-enoate
CID 130475774
3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;(2-methyl-3-trimethoxysilylpropyl) 2-methylprop-2-enoate
CID 87696910
ethane;(3-hydroxy-2-methylpropyl) 2-methylprop-2-enoate
CID 171797944
3-O-[3-(2-ethoxycarbonylprop-2-enoyloxy)-2-methylpropyl] 1-O-ethyl 2-methylidenepropanedioate
CID 155375651
sodium ethyl 2-methylprop-2-enoate
CID 23346885
ethane;bis(ethyl 2-methylprop-2-enoate)
CID 146295289
ethyl 2-methylprop-2-enoate;phosphane
CID 159151613
ethyl 2-methylprop-2-enoate;methane
CID 159235789
[acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate
CID 22457247
butan-2-ol;ethyl 2-methylprop-2-enoate
CID 91162607
3-[diethoxy(pentan-2-yloxy)silyl]propyl 2-methylprop-2-enoate
CID 141157653
[2,4-dimethyl-5-(2-methylprop-2-enoyloxy)pentyl]-triethylphosphanium
CID 134171436

Frequently Asked Questions

What is the IUPAC name of (2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate?
The IUPAC name of (2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate (CID 22597143) is (2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate.
What is the SMILES notation for (2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate?
The canonical SMILES for (2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate is C=C(C)C(=O)OCC(C)C[Si](OCC)(OCC)OCC.
What is the InChIKey of (2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate?
The InChIKey is ABAAFUXTIYJPIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O5Si/c1-7-17-20(18-8-2,19-9-3)11-13(6)10-16-14(15)12(4)5/h13H,4,7-11H2,1-3,5-6H3.
What are the key properties of (2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate?
(2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate has a molecular weight of 304.46 g/mol, XLogP of 2.79, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate is sourced from PubChem (CID 22597143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).