octyl triethylsilyl carbonate

C15H32O3Si — CID 155712726

IUPACoctyl triethylsilyl carbonate
SMILESCCCCCCCCOC(=O)O[Si](CC)(CC)CC
InChIInChI=1S/C15H32O3Si/c1-5-9-10-11-12-13-14-17-15(16)18-19(6-2,7-3)8-4/h5-14H2,1-4H3
InChIKeyIRSMBOLLNFLACE-UHFFFAOYSA-N
MW288.50 g/mol
LogP5.51
Rot. Bonds11

About octyl triethylsilyl carbonate

octyl triethylsilyl carbonate (PubChem CID 155712726) has the molecular formula C15H32O3Si and a molecular weight of 288.50 g/mol. Its IUPAC name is octyl triethylsilyl carbonate.

Molecular Properties

Compound Nameoctyl triethylsilyl carbonate
PubChem CID155712726
Molecular FormulaC15H32O3Si
Molecular Weight288.50 g/mol
Exact Mass288.21
IUPAC Nameoctyl triethylsilyl carbonate
SMILESCCCCCCCCOC(=O)O[Si](CC)(CC)CC
InChIInChI=1S/C15H32O3Si/c1-5-9-10-11-12-13-14-17-15(16)18-19(6-2,7-3)8-4/h5-14H2,1-4H3
InChIKeyIRSMBOLLNFLACE-UHFFFAOYSA-N
XLogP5.51
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.50
LogP ≤ 55.51
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

decyl triethylsilyl carbonate
CID 155712740
heptyl octyl carbonate
CID 21498015
dioctyl carbonate
CID 174882674
hexyl undecyl carbonate
CID 87299622
hexadecyl hexyl carbonate
CID 87300395
nonyl tri(propan-2-yl)silyl carbonate
CID 155712658
azane;dioctyl carbonate
CID 174626203
hexoxycarbonyl hexyl carbonate
CID 18974231
butyl pentyl carbonate
CID 545576
5-butoxycarbonyloxypentyl butyl carbonate
CID 91694808
[dimethyl(propan-2-yl)silyl] octyl carbonate
CID 155712707
chloro hexyl carbonate
CID 90046740

Frequently Asked Questions

What is the IUPAC name of octyl triethylsilyl carbonate?
The IUPAC name of octyl triethylsilyl carbonate (CID 155712726) is octyl triethylsilyl carbonate.
What is the SMILES notation for octyl triethylsilyl carbonate?
The canonical SMILES for octyl triethylsilyl carbonate is CCCCCCCCOC(=O)O[Si](CC)(CC)CC.
What is the InChIKey of octyl triethylsilyl carbonate?
The InChIKey is IRSMBOLLNFLACE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O3Si/c1-5-9-10-11-12-13-14-17-15(16)18-19(6-2,7-3)8-4/h5-14H2,1-4H3.
What are the key properties of octyl triethylsilyl carbonate?
octyl triethylsilyl carbonate has a molecular weight of 288.50 g/mol, XLogP of 5.51, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for octyl triethylsilyl carbonate is sourced from PubChem (CID 155712726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).