9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate

C16H32O5Si — CID 170945913

IUPAC9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate
SMILESC=CC(=O)OCCCCCCCCC[Si](OC)(OC)OCC
InChIInChI=1S/C16H32O5Si/c1-5-16(17)20-14-12-10-8-7-9-11-13-15-22(18-3,19-4)21-6-2/h5H,1,6-15H2,2-4H3
InChIKeyNHTHRCCQEQWMJG-UHFFFAOYSA-N
MW332.51 g/mol
LogP3.71
Rot. Bonds15

About 9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate

9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate (PubChem CID 170945913) has the molecular formula C16H32O5Si and a molecular weight of 332.51 g/mol. Its IUPAC name is 9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate.

Molecular Properties

Compound Name9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate
PubChem CID170945913
Molecular FormulaC16H32O5Si
Molecular Weight332.51 g/mol
Exact Mass332.20
IUPAC Name9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate
SMILESC=CC(=O)OCCCCCCCCC[Si](OC)(OC)OCC
InChIInChI=1S/C16H32O5Si/c1-5-16(17)20-14-12-10-8-7-9-11-13-15-22(18-3,19-4)21-6-2/h5H,1,6-15H2,2-4H3
InChIKeyNHTHRCCQEQWMJG-UHFFFAOYSA-N
XLogP3.71
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.51
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate
CID 141313483
prop-2-enoic acid;3-triethoxysilylpropyl prop-2-enoate
CID 158718289
3-[dimethoxy(methyl)silyl]propyl prop-2-enoate;3-triethoxysilylpropyl prop-2-enoate
CID 87188845
3-trimethoxysilylpropyl prop-2-enoate;hydrate
CID 141437630
2-[diethoxy(undecyl)silyl]oxyethyl prop-2-enoate
CID 151648316
3-[[dimethoxy(3-prop-2-enoyloxypropyl)silyl]oxy-dimethoxysilyl]propyl prop-2-enoate
CID 18468769
8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate
CID 140662216
8-[methoxy(dimethyl)silyl]octyl prop-2-enoate
CID 140662219
phosphoric acid;3-trimethoxysilylpropyl prop-2-enoate
CID 174981814
4-[dibutyl(ethoxy)silyl]butyl prop-2-enoate
CID 150064370
13-[dimethoxy(propyl)silyl]tridecyl prop-2-enoate
CID 150352297
CID 166519746
CID 166519746

Frequently Asked Questions

What is the IUPAC name of 9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate?
The IUPAC name of 9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate (CID 170945913) is 9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate.
What is the SMILES notation for 9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate?
The canonical SMILES for 9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate is C=CC(=O)OCCCCCCCCC[Si](OC)(OC)OCC.
What is the InChIKey of 9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate?
The InChIKey is NHTHRCCQEQWMJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O5Si/c1-5-16(17)20-14-12-10-8-7-9-11-13-15-22(18-3,19-4)21-6-2/h5H,1,6-15H2,2-4H3.
What are the key properties of 9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate?
9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate has a molecular weight of 332.51 g/mol, XLogP of 3.71, 15 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate is sourced from PubChem (CID 170945913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).