4-ethyldecanoic acid;triethoxysilane

C18H40O5Si — CID 175072364

IUPAC4-ethyldecanoic acid;triethoxysilane
SMILESCCCCCCC(CC)CCC(=O)O.CCO[SiH](OCC)OCC
InChIInChI=1S/C12H24O2.C6H16O3Si/c1-3-5-6-7-8-11(4-2)9-10-12(13)14;1-4-7-10(8-5-2)9-6-3/h11H,3-10H2,1-2H3,(H,13,14);10H,4-6H2,1-3H3
InChIKeyJLBMFPDTPSGFBI-UHFFFAOYSA-N
MW364.60 g/mol
LogP4.66
Rot. Bonds15

About 4-ethyldecanoic acid;triethoxysilane

4-ethyldecanoic acid;triethoxysilane (PubChem CID 175072364) has the molecular formula C18H40O5Si and a molecular weight of 364.60 g/mol. Its IUPAC name is 4-ethyldecanoic acid;triethoxysilane.

Molecular Properties

Compound Name4-ethyldecanoic acid;triethoxysilane
PubChem CID175072364
Molecular FormulaC18H40O5Si
Molecular Weight364.60 g/mol
Exact Mass364.26
IUPAC Name4-ethyldecanoic acid;triethoxysilane
SMILESCCCCCCC(CC)CCC(=O)O.CCO[SiH](OCC)OCC
InChIInChI=1S/C12H24O2.C6H16O3Si/c1-3-5-6-7-8-11(4-2)9-10-12(13)14;1-4-7-10(8-5-2)9-6-3/h11H,3-10H2,1-2H3,(H,13,14);10H,4-6H2,1-3H3
InChIKeyJLBMFPDTPSGFBI-UHFFFAOYSA-N
XLogP4.66
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.60
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

9-ethyloctadecanoic acid
CID 11045212
7-ethyldodecanoic acid
CID 5282689
4-decyl-11-pentylnonadecanoic acid
CID 57279723
4-ethylicosanedioic acid;dihydrochloride
CID 89462723
5-ethylundecan-2-one
CID 90150873
23-pentylpentatetracontanedioic acid
CID 141048477
10-hexyloctadecanoic acid
CID 91174619
azane;7-ethyloctadecanedioic acid
CID 173365453
2-(6-ethylpentadecyl)propanedioic acid
CID 87568390
6-ethylnonanoic acid
CID 19689071
3-ethylhexadecanoic acid
CID 14298660
5-ethyldecanedioic acid
CID 54495296

Frequently Asked Questions

What is the IUPAC name of 4-ethyldecanoic acid;triethoxysilane?
The IUPAC name of 4-ethyldecanoic acid;triethoxysilane (CID 175072364) is 4-ethyldecanoic acid;triethoxysilane.
What is the SMILES notation for 4-ethyldecanoic acid;triethoxysilane?
The canonical SMILES for 4-ethyldecanoic acid;triethoxysilane is CCCCCCC(CC)CCC(=O)O.CCO[SiH](OCC)OCC.
What is the InChIKey of 4-ethyldecanoic acid;triethoxysilane?
The InChIKey is JLBMFPDTPSGFBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2.C6H16O3Si/c1-3-5-6-7-8-11(4-2)9-10-12(13)14;1-4-7-10(8-5-2)9-6-3/h11H,3-10H2,1-2H3,(H,13,14);10H,4-6H2,1-3H3.
What are the key properties of 4-ethyldecanoic acid;triethoxysilane?
4-ethyldecanoic acid;triethoxysilane has a molecular weight of 364.60 g/mol, XLogP of 4.66, 15 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyldecanoic acid;triethoxysilane is sourced from PubChem (CID 175072364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).