2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate

C12H24O6Si — CID 171586984

IUPAC2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate
SMILESC=CC(=O)OCCOCCOCC[Si](C)(OC)OC
InChIInChI=1S/C12H24O6Si/c1-5-12(13)18-9-8-16-6-7-17-10-11-19(4,14-2)15-3/h5H,1,6-11H2,2-4H3
InChIKeyYTVZXSXXICXDJJ-UHFFFAOYSA-N
MW292.40 g/mol
LogP1.11
Rot. Bonds12

About 2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate

2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate (PubChem CID 171586984) has the molecular formula C12H24O6Si and a molecular weight of 292.40 g/mol. Its IUPAC name is 2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate.

Molecular Properties

Compound Name2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate
PubChem CID171586984
Molecular FormulaC12H24O6Si
Molecular Weight292.40 g/mol
Exact Mass292.13
IUPAC Name2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate
SMILESC=CC(=O)OCCOCCOCC[Si](C)(OC)OC
InChIInChI=1S/C12H24O6Si/c1-5-12(13)18-9-8-16-6-7-17-10-11-19(4,14-2)15-3/h5H,1,6-11H2,2-4H3
InChIKeyYTVZXSXXICXDJJ-UHFFFAOYSA-N
XLogP1.11
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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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Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate?
The IUPAC name of 2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate (CID 171586984) is 2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate.
What is the SMILES notation for 2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate?
The canonical SMILES for 2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate is C=CC(=O)OCCOCCOCC[Si](C)(OC)OC.
What is the InChIKey of 2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate?
The InChIKey is YTVZXSXXICXDJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O6Si/c1-5-12(13)18-9-8-16-6-7-17-10-11-19(4,14-2)15-3/h5H,1,6-11H2,2-4H3.
What are the key properties of 2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate?
2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate has a molecular weight of 292.40 g/mol, XLogP of 1.11, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[dimethoxy(methyl)silyl]ethoxy]ethoxy]ethyl prop-2-enoate is sourced from PubChem (CID 171586984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).