8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate

C15H30O4Si — CID 140662216

IUPAC8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate
SMILESC=CC(=O)OCCCCCCCC[Si](CC)(OC)OC
InChIInChI=1S/C15H30O4Si/c1-5-15(16)19-13-11-9-7-8-10-12-14-20(6-2,17-3)18-4/h5H,1,6-14H2,2-4H3
InChIKeyZJTOHNQJWQJUQA-UHFFFAOYSA-N
MW302.49 g/mol
LogP3.81
Rot. Bonds13

About 8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate

8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate (PubChem CID 140662216) has the molecular formula C15H30O4Si and a molecular weight of 302.49 g/mol. Its IUPAC name is 8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate.

Molecular Properties

Compound Name8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate
PubChem CID140662216
Molecular FormulaC15H30O4Si
Molecular Weight302.49 g/mol
Exact Mass302.19
IUPAC Name8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate
SMILESC=CC(=O)OCCCCCCCC[Si](CC)(OC)OC
InChIInChI=1S/C15H30O4Si/c1-5-15(16)19-13-11-9-7-8-10-12-14-20(6-2,17-3)18-4/h5H,1,6-14H2,2-4H3
InChIKeyZJTOHNQJWQJUQA-UHFFFAOYSA-N
XLogP3.81
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.49
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

13-[dimethoxy(propyl)silyl]tridecyl prop-2-enoate
CID 150352297
3-[dimethoxy(propyl)silyl]propyl prop-2-enoate
CID 21432068
8-[methoxy(dimethyl)silyl]octyl prop-2-enoate
CID 140662219
3-[chloromethyl(dimethoxy)silyl]propyl prop-2-enoate
CID 141320580
9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate
CID 170945913
3-[diethyl(methoxy)silyl]propyl prop-2-enoate
CID 18331018
8-prop-2-enoyloxyoctyl prop-2-enoate
CID 12934232
4-prop-2-enoyloxybutyl prop-2-enoate;6-prop-2-enoyloxyhexyl prop-2-enoate
CID 158256375
decyl prop-2-enoate
CID 162172023
docosyl prop-2-enoate;henicosyl prop-2-enoate;tetracosyl prop-2-enoate;tricosyl prop-2-enoate
CID 161245650
hexyl prop-2-enoate
CID 17259
pentatriacontyl prop-2-enoate
CID 141309454

Frequently Asked Questions

What is the IUPAC name of 8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate?
The IUPAC name of 8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate (CID 140662216) is 8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate.
What is the SMILES notation for 8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate?
The canonical SMILES for 8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate is C=CC(=O)OCCCCCCCC[Si](CC)(OC)OC.
What is the InChIKey of 8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate?
The InChIKey is ZJTOHNQJWQJUQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O4Si/c1-5-15(16)19-13-11-9-7-8-10-12-14-20(6-2,17-3)18-4/h5H,1,6-14H2,2-4H3.
What are the key properties of 8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate?
8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate has a molecular weight of 302.49 g/mol, XLogP of 3.81, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[ethyl(dimethoxy)silyl]octyl prop-2-enoate is sourced from PubChem (CID 140662216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).