butyl-dimethoxy-tetradecylsilane

C20H44O2Si — CID 139614249

IUPACbutyl-dimethoxy-tetradecylsilane
SMILESCCCCCCCCCCCCCC[Si](CCCC)(OC)OC
InChIInChI=1S/C20H44O2Si/c1-5-7-9-10-11-12-13-14-15-16-17-18-20-23(21-3,22-4)19-8-6-2/h5-20H2,1-4H3
InChIKeyTYSMEEVMNMMPHP-UHFFFAOYSA-N
MW344.66 g/mol
LogP7.22
Rot. Bonds18

About butyl-dimethoxy-tetradecylsilane

butyl-dimethoxy-tetradecylsilane (PubChem CID 139614249) has the molecular formula C20H44O2Si and a molecular weight of 344.66 g/mol. Its IUPAC name is butyl-dimethoxy-tetradecylsilane.

Molecular Properties

Compound Namebutyl-dimethoxy-tetradecylsilane
PubChem CID139614249
Molecular FormulaC20H44O2Si
Molecular Weight344.66 g/mol
Exact Mass344.31
IUPAC Namebutyl-dimethoxy-tetradecylsilane
SMILESCCCCCCCCCCCCCC[Si](CCCC)(OC)OC
InChIInChI=1S/C20H44O2Si/c1-5-7-9-10-11-12-13-14-15-16-17-18-20-23(21-3,22-4)19-8-6-2/h5-20H2,1-4H3
InChIKeyTYSMEEVMNMMPHP-UHFFFAOYSA-N
XLogP7.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.66
LogP ≤ 57.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of butyl-dimethoxy-tetradecylsilane?
The IUPAC name of butyl-dimethoxy-tetradecylsilane (CID 139614249) is butyl-dimethoxy-tetradecylsilane.
What is the SMILES notation for butyl-dimethoxy-tetradecylsilane?
The canonical SMILES for butyl-dimethoxy-tetradecylsilane is CCCCCCCCCCCCCC[Si](CCCC)(OC)OC.
What is the InChIKey of butyl-dimethoxy-tetradecylsilane?
The InChIKey is TYSMEEVMNMMPHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H44O2Si/c1-5-7-9-10-11-12-13-14-15-16-17-18-20-23(21-3,22-4)19-8-6-2/h5-20H2,1-4H3.
What are the key properties of butyl-dimethoxy-tetradecylsilane?
butyl-dimethoxy-tetradecylsilane has a molecular weight of 344.66 g/mol, XLogP of 7.22, 18 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-dimethoxy-tetradecylsilane is sourced from PubChem (CID 139614249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).