hexacosyl(trimethoxy)silane

C29H62O3Si — CID 150262252

IUPAChexacosyl(trimethoxy)silane
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCC[Si](OC)(OC)OC
InChIInChI=1S/C29H62O3Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-33(30-2,31-3)32-4/h5-29H2,1-4H3
InChIKeyGBUJQGAFDDOMKF-UHFFFAOYSA-N
MW486.90 g/mol
LogP10.25
Rot. Bonds28

About hexacosyl(trimethoxy)silane

hexacosyl(trimethoxy)silane (PubChem CID 150262252) has the molecular formula C29H62O3Si and a molecular weight of 486.90 g/mol. Its IUPAC name is hexacosyl(trimethoxy)silane.

Molecular Properties

Compound Namehexacosyl(trimethoxy)silane
PubChem CID150262252
Molecular FormulaC29H62O3Si
Molecular Weight486.90 g/mol
Exact Mass486.45
IUPAC Namehexacosyl(trimethoxy)silane
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCC[Si](OC)(OC)OC
InChIInChI=1S/C29H62O3Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-33(30-2,31-3)32-4/h5-29H2,1-4H3
InChIKeyGBUJQGAFDDOMKF-UHFFFAOYSA-N
XLogP10.25
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds28
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.90
LogP ≤ 510.25
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

hexane;bis(hexyl(trimethoxy)silane)
CID 175053771
trimethoxy(pentacontyl)silane
CID 87930715
dodecyl(trimethoxy)silane;octane
CID 174570785
decyl(trimethoxy)silane;hexyl(trimethoxy)silane
CID 22665206
trimethoxy(undecyl)silane;hydrobromide
CID 172731268
dodecyl(trimethoxy)silane;λ2-plumbane
CID 175120013
azane;trimethoxy(pentyl)silane
CID 19608931
decyl(trimethoxy)silane;trimethoxysilane
CID 158226172
[dimethoxy(octyl)silyl]oxy-[dodecyl(dimethoxy)silyl]oxy-methoxy-octylsilane
CID 168727663
heptadecyl(trimethoxy)silane;triethoxy(heptadecyl)silane
CID 161331020
ethoxysilane;hexadecyl(trimethoxy)silane
CID 162057078
dodecyl-diethoxy-methoxysilane
CID 141483107

Frequently Asked Questions

What is the IUPAC name of hexacosyl(trimethoxy)silane?
The IUPAC name of hexacosyl(trimethoxy)silane (CID 150262252) is hexacosyl(trimethoxy)silane.
What is the SMILES notation for hexacosyl(trimethoxy)silane?
The canonical SMILES for hexacosyl(trimethoxy)silane is CCCCCCCCCCCCCCCCCCCCCCCCCC[Si](OC)(OC)OC.
What is the InChIKey of hexacosyl(trimethoxy)silane?
The InChIKey is GBUJQGAFDDOMKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H62O3Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-33(30-2,31-3)32-4/h5-29H2,1-4H3.
What are the key properties of hexacosyl(trimethoxy)silane?
hexacosyl(trimethoxy)silane has a molecular weight of 486.90 g/mol, XLogP of 10.25, 28 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hexacosyl(trimethoxy)silane is sourced from PubChem (CID 150262252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).