ethanol;trimethoxysilyl 2-methylprop-2-enoate

C9H20O6Si — CID 175501834

IUPACethanol;trimethoxysilyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O[Si](OC)(OC)OC.CCO
InChIInChI=1S/C7H14O5Si.C2H6O/c1-6(2)7(8)12-13(9-3,10-4)11-5;1-2-3/h1H2,2-5H3;3H,2H2,1H3
InChIKeyZFCKEYFYHMTQCD-UHFFFAOYSA-N
MW252.34 g/mol
LogP0.48
Rot. Bonds5

About ethanol;trimethoxysilyl 2-methylprop-2-enoate

ethanol;trimethoxysilyl 2-methylprop-2-enoate (PubChem CID 175501834) has the molecular formula C9H20O6Si and a molecular weight of 252.34 g/mol. Its IUPAC name is ethanol;trimethoxysilyl 2-methylprop-2-enoate.

Molecular Properties

Compound Nameethanol;trimethoxysilyl 2-methylprop-2-enoate
PubChem CID175501834
Molecular FormulaC9H20O6Si
Molecular Weight252.34 g/mol
Exact Mass252.10
IUPAC Nameethanol;trimethoxysilyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)O[Si](OC)(OC)OC.CCO
InChIInChI=1S/C7H14O5Si.C2H6O/c1-6(2)7(8)12-13(9-3,10-4)11-5;1-2-3/h1H2,2-5H3;3H,2H2,1H3
InChIKeyZFCKEYFYHMTQCD-UHFFFAOYSA-N
XLogP0.48
TPSA74.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

[methoxy(dimethyl)silyl] 2-methylprop-2-enoate
CID 87401455
[butoxy-bis(2-methylprop-2-enoyloxy)silyl] 2-methylprop-2-enoate
CID 88695289
tris(trimethylsilyloxy)silyl 2-methylprop-2-enoate
CID 23108290
ethane-1,2-diol;trimethylsilyl 2-methylprop-2-enoate
CID 87381259
[butyl(dimethoxy)silyl] 2-methylprop-2-enoate
CID 87481263
1-trimethoxysilyloxysilylpropyl 2-methylprop-2-enoate
CID 151704655
ethane-1,2-diol;2-methylprop-2-eneperoxoic acid
CID 87450882
trimethoxysilyl propanoate
CID 87655017
tris(hydroxymethyl 2-methylprop-2-enoate);propane
CID 157070076
hydroxymethyl 2-methylprop-2-enoate
CID 159274421
ethyl 2-methylprop-2-enoate
CID 130475774
[dibutyl(2-methylprop-2-enoyloxy)silyl] 2-methylprop-2-enoate
CID 153439669

Frequently Asked Questions

What is the IUPAC name of ethanol;trimethoxysilyl 2-methylprop-2-enoate?
The IUPAC name of ethanol;trimethoxysilyl 2-methylprop-2-enoate (CID 175501834) is ethanol;trimethoxysilyl 2-methylprop-2-enoate.
What is the SMILES notation for ethanol;trimethoxysilyl 2-methylprop-2-enoate?
The canonical SMILES for ethanol;trimethoxysilyl 2-methylprop-2-enoate is C=C(C)C(=O)O[Si](OC)(OC)OC.CCO.
What is the InChIKey of ethanol;trimethoxysilyl 2-methylprop-2-enoate?
The InChIKey is ZFCKEYFYHMTQCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O5Si.C2H6O/c1-6(2)7(8)12-13(9-3,10-4)11-5;1-2-3/h1H2,2-5H3;3H,2H2,1H3.
What are the key properties of ethanol;trimethoxysilyl 2-methylprop-2-enoate?
ethanol;trimethoxysilyl 2-methylprop-2-enoate has a molecular weight of 252.34 g/mol, XLogP of 0.48, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;trimethoxysilyl 2-methylprop-2-enoate is sourced from PubChem (CID 175501834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).