4-ethylnonadecan-3-yl(trimethoxy)silane

C24H52O3Si — CID 88743379

IUPAC4-ethylnonadecan-3-yl(trimethoxy)silane
SMILESCCCCCCCCCCCCCCCC(CC)C(CC)[Si](OC)(OC)OC
InChIInChI=1S/C24H52O3Si/c1-7-10-11-12-13-14-15-16-17-18-19-20-21-22-23(8-2)24(9-3)28(25-4,26-5)27-6/h23-24H,7-22H2,1-6H3
InChIKeyOCAFRGSGDRCJPC-UHFFFAOYSA-N
MW416.76 g/mol
LogP8.15
Rot. Bonds21

About 4-ethylnonadecan-3-yl(trimethoxy)silane

4-ethylnonadecan-3-yl(trimethoxy)silane (PubChem CID 88743379) has the molecular formula C24H52O3Si and a molecular weight of 416.76 g/mol. Its IUPAC name is 4-ethylnonadecan-3-yl(trimethoxy)silane.

Molecular Properties

Compound Name4-ethylnonadecan-3-yl(trimethoxy)silane
PubChem CID88743379
Molecular FormulaC24H52O3Si
Molecular Weight416.76 g/mol
Exact Mass416.37
IUPAC Name4-ethylnonadecan-3-yl(trimethoxy)silane
SMILESCCCCCCCCCCCCCCCC(CC)C(CC)[Si](OC)(OC)OC
InChIInChI=1S/C24H52O3Si/c1-7-10-11-12-13-14-15-16-17-18-19-20-21-22-23(8-2)24(9-3)28(25-4,26-5)27-6/h23-24H,7-22H2,1-6H3
InChIKeyOCAFRGSGDRCJPC-UHFFFAOYSA-N
XLogP8.15
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds21
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.76
LogP ≤ 58.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

azane;4-(2-chloroethyl)tricosan-3-yl-trimethoxysilane
CID 87229515
azane;4-(2-chloroethyl)pentadecan-3-yl-trimethoxysilane
CID 87229345
2-methyl-3-(1-trimethoxysilylpropyl)heptadecan-2-amine
CID 87122398
9,10-diethyloctadecane
CID 530164
19-heptadecan-3-ylnonatriacontane
CID 57212477
6-ethyl-7-pentyltetradecane
CID 123140274
5,6-diethyldodecane
CID 90761715
4-ethyl-3-methylundecane
CID 57279647
1-trimethoxysilyloctan-1-amine
CID 87463125
5-butyl-6-ethyldodecane
CID 529932
N-(1-trimethoxysilylpropyl)hexan-1-amine
CID 87290664
7,8-dihexylicosane
CID 21490611

Frequently Asked Questions

What is the IUPAC name of 4-ethylnonadecan-3-yl(trimethoxy)silane?
The IUPAC name of 4-ethylnonadecan-3-yl(trimethoxy)silane (CID 88743379) is 4-ethylnonadecan-3-yl(trimethoxy)silane.
What is the SMILES notation for 4-ethylnonadecan-3-yl(trimethoxy)silane?
The canonical SMILES for 4-ethylnonadecan-3-yl(trimethoxy)silane is CCCCCCCCCCCCCCCC(CC)C(CC)[Si](OC)(OC)OC.
What is the InChIKey of 4-ethylnonadecan-3-yl(trimethoxy)silane?
The InChIKey is OCAFRGSGDRCJPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52O3Si/c1-7-10-11-12-13-14-15-16-17-18-19-20-21-22-23(8-2)24(9-3)28(25-4,26-5)27-6/h23-24H,7-22H2,1-6H3.
What are the key properties of 4-ethylnonadecan-3-yl(trimethoxy)silane?
4-ethylnonadecan-3-yl(trimethoxy)silane has a molecular weight of 416.76 g/mol, XLogP of 8.15, 21 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylnonadecan-3-yl(trimethoxy)silane is sourced from PubChem (CID 88743379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).