26-trimethoxysilylhexacosan-1-ol

C29H62O4Si — CID 87686281

IUPAC26-trimethoxysilylhexacosan-1-ol
SMILESCO[Si](CCCCCCCCCCCCCCCCCCCCCCCCCCO)(OC)OC
InChIInChI=1S/C29H62O4Si/c1-31-34(32-2,33-3)29-27-25-23-21-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22-24-26-28-30/h30H,4-29H2,1-3H3
InChIKeyQLBYDPBQUYHNDJ-UHFFFAOYSA-N
MW502.90 g/mol
LogP9.22
Rot. Bonds29

About 26-trimethoxysilylhexacosan-1-ol

26-trimethoxysilylhexacosan-1-ol (PubChem CID 87686281) has the molecular formula C29H62O4Si and a molecular weight of 502.90 g/mol. Its IUPAC name is 26-trimethoxysilylhexacosan-1-ol.

Molecular Properties

Compound Name26-trimethoxysilylhexacosan-1-ol
PubChem CID87686281
Molecular FormulaC29H62O4Si
Molecular Weight502.90 g/mol
Exact Mass502.44
IUPAC Name26-trimethoxysilylhexacosan-1-ol
SMILESCO[Si](CCCCCCCCCCCCCCCCCCCCCCCCCCO)(OC)OC
InChIInChI=1S/C29H62O4Si/c1-31-34(32-2,33-3)29-27-25-23-21-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22-24-26-28-30/h30H,4-29H2,1-3H3
InChIKeyQLBYDPBQUYHNDJ-UHFFFAOYSA-N
XLogP9.22
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds29
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500502.90
LogP ≤ 59.22
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

31-trimethoxysilylhentriacontan-1-ol
CID 87684107
6-trimethoxysilylhexan-1-ol
CID 22497813
16-trimethoxysilylhexadecan-1-ol
CID 87683754
trimethoxy(6-trimethoxysilylhexyl)silane
CID 158013726
37-triethoxysilylheptatriacontan-1-ol
CID 87684596
methoxymethane;octane-1,8-diol
CID 175193596
decyl(trimethoxy)silane;hexyl(trimethoxy)silane
CID 22665206
33-trimethoxysilyltritriacontan-1-amine
CID 87686996
36-trimethoxysilylhexatriacontan-1-amine
CID 87680936
hexane;bis(hexyl(trimethoxy)silane)
CID 175053771
trimethoxy(pentacontyl)silane
CID 87930715
hexacosyl(trimethoxy)silane
CID 150262252

Frequently Asked Questions

What is the IUPAC name of 26-trimethoxysilylhexacosan-1-ol?
The IUPAC name of 26-trimethoxysilylhexacosan-1-ol (CID 87686281) is 26-trimethoxysilylhexacosan-1-ol.
What is the SMILES notation for 26-trimethoxysilylhexacosan-1-ol?
The canonical SMILES for 26-trimethoxysilylhexacosan-1-ol is CO[Si](CCCCCCCCCCCCCCCCCCCCCCCCCCO)(OC)OC.
What is the InChIKey of 26-trimethoxysilylhexacosan-1-ol?
The InChIKey is QLBYDPBQUYHNDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H62O4Si/c1-31-34(32-2,33-3)29-27-25-23-21-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22-24-26-28-30/h30H,4-29H2,1-3H3.
What are the key properties of 26-trimethoxysilylhexacosan-1-ol?
26-trimethoxysilylhexacosan-1-ol has a molecular weight of 502.90 g/mol, XLogP of 9.22, 29 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 26-trimethoxysilylhexacosan-1-ol is sourced from PubChem (CID 87686281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).