trimethylsilyl 2-trimethylsilyloxydecanoate

C16H36O3Si2 — CID 91749583

IUPACtrimethylsilyl 2-trimethylsilyloxydecanoate
SMILESCCCCCCCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C16H36O3Si2/c1-8-9-10-11-12-13-14-15(18-20(2,3)4)16(17)19-21(5,6)7/h15H,8-14H2,1-7H3
InChIKeyDSCFWMWOXRNBJP-UHFFFAOYSA-N
MW332.63 g/mol
LogP5.34
Rot. Bonds11

About trimethylsilyl 2-trimethylsilyloxydecanoate

trimethylsilyl 2-trimethylsilyloxydecanoate (PubChem CID 91749583) has the molecular formula C16H36O3Si2 and a molecular weight of 332.63 g/mol. Its IUPAC name is trimethylsilyl 2-trimethylsilyloxydecanoate.

Molecular Properties

Compound Nametrimethylsilyl 2-trimethylsilyloxydecanoate
PubChem CID91749583
Molecular FormulaC16H36O3Si2
Molecular Weight332.63 g/mol
Exact Mass332.22
IUPAC Nametrimethylsilyl 2-trimethylsilyloxydecanoate
SMILESCCCCCCCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C16H36O3Si2/c1-8-9-10-11-12-13-14-15(18-20(2,3)4)16(17)19-21(5,6)7/h15H,8-14H2,1-7H3
InChIKeyDSCFWMWOXRNBJP-UHFFFAOYSA-N
XLogP5.34
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.63
LogP ≤ 55.34
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

Hexadecanoic acid, 2-[(trimethylsilyl)oxy]-, methyl ester
CID 524469
Methyl 16-[(trimethylsilyl)oxy]hexadecanoate
CID 554929
methyl (6S,7S,16S)-6,7,16-tris(trimethylsilyloxy)heptadecanoate
CID 162911043
Octadecanoic acid, 2-[(trimethylsilyl)oxy]-, methyl ester
CID 524479
2,3-Bis[(trimethylsilyl)oxy]propyl icosanoate
CID 537899
2,3-Bis(trimethylsilyloxy)propyl hexadecanoate
CID 552033
Hexadecanoic acid, 2-[(trimethylsilyl)oxy]-1-[[(trimethylsilyl)oxy]methyl]ethyl ester
CID 552917
2,3-Bis[(trimethylsilyl)oxy]propyl stearate
CID 553936
2,3-Bis[(trimethylsilyl)oxy]propyl dodecanoate
CID 628819
Trimethylsilyl 3-trimethylsilyloxydecanoate
CID 553117
Octadecanoic acid, 9,10-bis[(trimethylsilyl)oxy]-, methyl ester
CID 553462
Octadecanoic acid, 12-[(trimethylsilyl)oxy]-, methyl ester
CID 604384

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 2-trimethylsilyloxydecanoate?
The IUPAC name of trimethylsilyl 2-trimethylsilyloxydecanoate (CID 91749583) is trimethylsilyl 2-trimethylsilyloxydecanoate.
What is the SMILES notation for trimethylsilyl 2-trimethylsilyloxydecanoate?
The canonical SMILES for trimethylsilyl 2-trimethylsilyloxydecanoate is CCCCCCCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl 2-trimethylsilyloxydecanoate?
The InChIKey is DSCFWMWOXRNBJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O3Si2/c1-8-9-10-11-12-13-14-15(18-20(2,3)4)16(17)19-21(5,6)7/h15H,8-14H2,1-7H3.
What are the key properties of trimethylsilyl 2-trimethylsilyloxydecanoate?
trimethylsilyl 2-trimethylsilyloxydecanoate has a molecular weight of 332.63 g/mol, XLogP of 5.34, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2-trimethylsilyloxydecanoate is sourced from PubChem (CID 91749583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).