2-methoxyethyl 4-trimethoxysilylbutanoate

C10H22O6Si — CID 58986420

IUPAC2-methoxyethyl 4-trimethoxysilylbutanoate
SMILESCOCCOC(=O)CCC[Si](OC)(OC)OC
InChIInChI=1S/C10H22O6Si/c1-12-7-8-16-10(11)6-5-9-17(13-2,14-3)15-4/h5-9H2,1-4H3
InChIKeyJBOQSMLKDUQGEZ-UHFFFAOYSA-N
MW266.37 g/mol
LogP0.83
Rot. Bonds10

About 2-methoxyethyl 4-trimethoxysilylbutanoate

2-methoxyethyl 4-trimethoxysilylbutanoate (PubChem CID 58986420) has the molecular formula C10H22O6Si and a molecular weight of 266.37 g/mol. Its IUPAC name is 2-methoxyethyl 4-trimethoxysilylbutanoate.

Molecular Properties

Compound Name2-methoxyethyl 4-trimethoxysilylbutanoate
PubChem CID58986420
Molecular FormulaC10H22O6Si
Molecular Weight266.37 g/mol
Exact Mass266.12
IUPAC Name2-methoxyethyl 4-trimethoxysilylbutanoate
SMILESCOCCOC(=O)CCC[Si](OC)(OC)OC
InChIInChI=1S/C10H22O6Si/c1-12-7-8-16-10(11)6-5-9-17(13-2,14-3)15-4/h5-9H2,1-4H3
InChIKeyJBOQSMLKDUQGEZ-UHFFFAOYSA-N
XLogP0.83
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 50.83
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'}

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Related Compounds

propyl 4-trimethoxysilylbutanoate
CID 174313237
2-ethoxyethyl 5-trimethoxysilylpentanoate
CID 158197775
2-methoxyethyl 5-methoxypentanoate
CID 58454735
2-methoxyethyl 18-hydroxyoctadecanoate
CID 54055898
4-trimethoxysilylbutanehydrazide
CID 12002198
2-methoxyethyl octanoate
CID 14009347
14-(2-methoxyethoxy)-14-oxotetradecanoic acid
CID 174560231
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl 3-aminopropanoate
CID 169082303
2-methoxyethyl 5-[[dimethyl(5-oxohexyl)silyl]oxy-dimethylsilyl]pentanoate
CID 161472912
2-methoxyethyl 18-acetyloxyoctadecanoate
CID 22678997
bis(2-methoxyethyl) octadec-9-enedioate
CID 123139794
10-O-(2-methoxyethyl) 1-O-octadecyl decanedioate
CID 91738078

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethyl 4-trimethoxysilylbutanoate?
The IUPAC name of 2-methoxyethyl 4-trimethoxysilylbutanoate (CID 58986420) is 2-methoxyethyl 4-trimethoxysilylbutanoate.
What is the SMILES notation for 2-methoxyethyl 4-trimethoxysilylbutanoate?
The canonical SMILES for 2-methoxyethyl 4-trimethoxysilylbutanoate is COCCOC(=O)CCC[Si](OC)(OC)OC.
What is the InChIKey of 2-methoxyethyl 4-trimethoxysilylbutanoate?
The InChIKey is JBOQSMLKDUQGEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O6Si/c1-12-7-8-16-10(11)6-5-9-17(13-2,14-3)15-4/h5-9H2,1-4H3.
What are the key properties of 2-methoxyethyl 4-trimethoxysilylbutanoate?
2-methoxyethyl 4-trimethoxysilylbutanoate has a molecular weight of 266.37 g/mol, XLogP of 0.83, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethyl 4-trimethoxysilylbutanoate is sourced from PubChem (CID 58986420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).