trimethoxy(4-methylicosyl)silane

C24H52O3Si — CID 88743380

IUPACtrimethoxy(4-methylicosyl)silane
SMILESCCCCCCCCCCCCCCCCC(C)CCC[Si](OC)(OC)OC
InChIInChI=1S/C24H52O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24(2)22-20-23-28(25-3,26-4)27-5/h24H,6-23H2,1-5H3
InChIKeyUYHRUBKMMMVSML-UHFFFAOYSA-N
MW416.76 g/mol
LogP8.15
Rot. Bonds22

About trimethoxy(4-methylicosyl)silane

trimethoxy(4-methylicosyl)silane (PubChem CID 88743380) has the molecular formula C24H52O3Si and a molecular weight of 416.76 g/mol. Its IUPAC name is trimethoxy(4-methylicosyl)silane.

Molecular Properties

Compound Nametrimethoxy(4-methylicosyl)silane
PubChem CID88743380
Molecular FormulaC24H52O3Si
Molecular Weight416.76 g/mol
Exact Mass416.37
IUPAC Nametrimethoxy(4-methylicosyl)silane
SMILESCCCCCCCCCCCCCCCCC(C)CCC[Si](OC)(OC)OC
InChIInChI=1S/C24H52O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24(2)22-20-23-28(25-3,26-4)27-5/h24H,6-23H2,1-5H3
InChIKeyUYHRUBKMMMVSML-UHFFFAOYSA-N
XLogP8.15
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds22
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

trimethoxy(4-methylheptyl)silane
CID 23534240
4-chlorohenicosyl(trimethoxy)silane
CID 141333665
trimethoxy-[4-(2-methylpropyl)undecyl]silane
CID 173194024
dodecyl(trimethoxy)silane;octane
CID 174570785
hexane;bis(hexyl(trimethoxy)silane)
CID 175053771
trimethoxy(pentacontyl)silane
CID 87930715
hexacosyl(trimethoxy)silane
CID 150262252
decyl(trimethoxy)silane;hexyl(trimethoxy)silane
CID 22665206
6-methyloctacosane
CID 22223942
27-methyltripentacontane
CID 91450521
8,13-dimethyloctacosane
CID 71323274
15-methylhexatriacontane
CID 86002594

Frequently Asked Questions

What is the IUPAC name of trimethoxy(4-methylicosyl)silane?
The IUPAC name of trimethoxy(4-methylicosyl)silane (CID 88743380) is trimethoxy(4-methylicosyl)silane.
What is the SMILES notation for trimethoxy(4-methylicosyl)silane?
The canonical SMILES for trimethoxy(4-methylicosyl)silane is CCCCCCCCCCCCCCCCC(C)CCC[Si](OC)(OC)OC.
What is the InChIKey of trimethoxy(4-methylicosyl)silane?
The InChIKey is UYHRUBKMMMVSML-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24(2)22-20-23-28(25-3,26-4)27-5/h24H,6-23H2,1-5H3.
What are the key properties of trimethoxy(4-methylicosyl)silane?
trimethoxy(4-methylicosyl)silane has a molecular weight of 416.76 g/mol, XLogP of 8.15, 22 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy(4-methylicosyl)silane is sourced from PubChem (CID 88743380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).