decyl triethylsilyl carbonate

C17H36O3Si — CID 155712740

IUPACdecyl triethylsilyl carbonate
SMILESCCCCCCCCCCOC(=O)O[Si](CC)(CC)CC
InChIInChI=1S/C17H36O3Si/c1-5-9-10-11-12-13-14-15-16-19-17(18)20-21(6-2,7-3)8-4/h5-16H2,1-4H3
InChIKeyKQESXZZXYDFHBG-UHFFFAOYSA-N
MW316.56 g/mol
LogP6.29
Rot. Bonds13

About decyl triethylsilyl carbonate

decyl triethylsilyl carbonate (PubChem CID 155712740) has the molecular formula C17H36O3Si and a molecular weight of 316.56 g/mol. Its IUPAC name is decyl triethylsilyl carbonate.

Molecular Properties

Compound Namedecyl triethylsilyl carbonate
PubChem CID155712740
Molecular FormulaC17H36O3Si
Molecular Weight316.56 g/mol
Exact Mass316.24
IUPAC Namedecyl triethylsilyl carbonate
SMILESCCCCCCCCCCOC(=O)O[Si](CC)(CC)CC
InChIInChI=1S/C17H36O3Si/c1-5-9-10-11-12-13-14-15-16-19-17(18)20-21(6-2,7-3)8-4/h5-16H2,1-4H3
InChIKeyKQESXZZXYDFHBG-UHFFFAOYSA-N
XLogP6.29
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.56
LogP ≤ 56.29
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

octyl triethylsilyl carbonate
CID 155712726
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
5-butoxycarbonyloxypentyl butyl carbonate
CID 91694808
butyl pentyl carbonate
CID 545576
[dimethyl(propan-2-yl)silyl] octyl carbonate
CID 155712707
chloro hexyl carbonate
CID 90046740

Frequently Asked Questions

What is the IUPAC name of decyl triethylsilyl carbonate?
The IUPAC name of decyl triethylsilyl carbonate (CID 155712740) is decyl triethylsilyl carbonate.
What is the SMILES notation for decyl triethylsilyl carbonate?
The canonical SMILES for decyl triethylsilyl carbonate is CCCCCCCCCCOC(=O)O[Si](CC)(CC)CC.
What is the InChIKey of decyl triethylsilyl carbonate?
The InChIKey is KQESXZZXYDFHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36O3Si/c1-5-9-10-11-12-13-14-15-16-19-17(18)20-21(6-2,7-3)8-4/h5-16H2,1-4H3.
What are the key properties of decyl triethylsilyl carbonate?
decyl triethylsilyl carbonate has a molecular weight of 316.56 g/mol, XLogP of 6.29, 13 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for decyl triethylsilyl carbonate is sourced from PubChem (CID 155712740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).