2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten

C14H32O6SiW2 — CID 176610338

IUPAC2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten
SMILESCCC(CO)(CO)COCCCCC[Si](OC)(OC)OC.[W].[W]
InChIInChI=1S/C14H32O6Si.2W/c1-5-14(11-15,12-16)13-20-9-7-6-8-10-21(17-2,18-3)19-4;;/h15-16H,5-13H2,1-4H3;;
InChIKeyVIBRADLKYVYOQF-UHFFFAOYSA-N
MW692.17 g/mol
LogP1.43
Rot. Bonds14

About 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten

2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten (PubChem CID 176610338) has the molecular formula C14H32O6SiW2 and a molecular weight of 692.17 g/mol. Its IUPAC name is 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten.

Molecular Properties

Compound Name2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten
PubChem CID176610338
Molecular FormulaC14H32O6SiW2
Molecular Weight692.17 g/mol
Exact Mass692.10
IUPAC Name2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten
SMILESCCC(CO)(CO)COCCCCC[Si](OC)(OC)OC.[W].[W]
InChIInChI=1S/C14H32O6Si.2W/c1-5-14(11-15,12-16)13-20-9-7-6-8-10-21(17-2,18-3)19-4;;/h15-16H,5-13H2,1-4H3;;
InChIKeyVIBRADLKYVYOQF-UHFFFAOYSA-N
XLogP1.43
TPSA77.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500692.17
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethyl-2-(octoxymethyl)propane-1,3-diol
CID 11345608
5-[2,2-bis(ethoxymethyl)-3-(5-trimethoxysilylpentoxy)propoxy]pentyl-trimethoxysilane;5-[2-(ethoxymethyl)-2-[[2-(ethoxymethyl)-3-(5-trimethoxysilylpentoxy)-2-(5-trimethoxysilylpentoxymethyl)propoxy]methyl]-3-(5-trimethoxysilylpentoxy)propoxy]pentyl-trimethoxysilane;3-[2-(ethoxymethyl)-2-[[2-(ethoxymethyl)-3-(3-trimethoxysilylpropoxy)-2-(3-trimethoxysilylpropoxymethyl)propoxy]methyl]-3-(3-trimethoxysilylpropoxy)propoxy]propyl-trimethoxysilane;5-[2-(ethoxymethyl)-3-(5-trimethoxysilylpentoxy)-2-[[3-(5-trimethoxysilylpentoxy)-2,2-bis(5-trimethoxysilylpentoxymethyl)propoxy]methyl]propoxy]pentyl-trimethoxysilane;3-[2-(ethoxymethyl)-3-(3-trimethoxysilylpropoxy)-2-[[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propoxy]methyl]propoxy]propyl-trimethoxysilane
CID 158154375
2,2-bis(decoxymethyl)butan-1-ol
CID 71361310
2-(hydroxymethyl)-2-(tridecoxymethyl)propane-1,3-diol
CID 22035112
trimethoxy-[11-(2-methoxyethoxy)undecyl]silane
CID 88574364
trimethoxy-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-octadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]silane
CID 155614579
2-[[2-[[2-[[2-(dodecoxymethyl)-3-methoxy-2-(methoxymethyl)propoxy]methyl]-3-methoxy-2-(methoxymethyl)propoxy]methyl]-3-methoxy-2-(methoxymethyl)propoxy]methyl]-3-methoxy-2-(methoxymethyl)propan-1-ol
CID 170388026
3-(3-trimethylsilylpropoxy)-2,2-bis(3-trimethylsilylpropoxymethyl)propan-1-ol
CID 158533030
2-ethyl-2-(hydroxymethoxymethyl)propane-1,3-diol
CID 175057771
2-[[2-[2,2-bis(hydroxymethyl)butoxymethyl]-3-hydroxy-2-(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol
CID 88891736
2-[2,2-bis[2-(3-trimethoxysilylpropylcarbamoyloxy)ethoxymethyl]butoxy]ethyl N-(3-trimethoxysilylpropyl)carbamate
CID 168787203
2-(5-butoxypentyl)-2-(octoxymethyl)propane-1,3-diol
CID 58492091

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten?
The IUPAC name of 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten (CID 176610338) is 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten.
What is the SMILES notation for 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten?
The canonical SMILES for 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten is CCC(CO)(CO)COCCCCC[Si](OC)(OC)OC.[W].[W].
What is the InChIKey of 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten?
The InChIKey is VIBRADLKYVYOQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O6Si.2W/c1-5-14(11-15,12-16)13-20-9-7-6-8-10-21(17-2,18-3)19-4;;/h15-16H,5-13H2,1-4H3;;.
What are the key properties of 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten?
2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten has a molecular weight of 692.17 g/mol, XLogP of 1.43, 14 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(5-trimethoxysilylpentoxymethyl)propane-1,3-diol;tungsten is sourced from PubChem (CID 176610338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).