methyl 2-trimethylsilyloxydecanoate

C14H30O3Si — CID 91748926

IUPACmethyl 2-trimethylsilyloxydecanoate
SMILESCCCCCCCCC(O[Si](C)(C)C)C(=O)OC
InChIInChI=1S/C14H30O3Si/c1-6-7-8-9-10-11-12-13(14(15)16-2)17-18(3,4)5/h13H,6-12H2,1-5H3
InChIKeyOPJOOLRQPVHOBJ-UHFFFAOYSA-N
MW274.48 g/mol
LogP4.13
Rot. Bonds10

About methyl 2-trimethylsilyloxydecanoate

methyl 2-trimethylsilyloxydecanoate (PubChem CID 91748926) has the molecular formula C14H30O3Si and a molecular weight of 274.48 g/mol. Its IUPAC name is methyl 2-trimethylsilyloxydecanoate.

Molecular Properties

Compound Namemethyl 2-trimethylsilyloxydecanoate
PubChem CID91748926
Molecular FormulaC14H30O3Si
Molecular Weight274.48 g/mol
Exact Mass274.20
IUPAC Namemethyl 2-trimethylsilyloxydecanoate
SMILESCCCCCCCCC(O[Si](C)(C)C)C(=O)OC
InChIInChI=1S/C14H30O3Si/c1-6-7-8-9-10-11-12-13(14(15)16-2)17-18(3,4)5/h13H,6-12H2,1-5H3
InChIKeyOPJOOLRQPVHOBJ-UHFFFAOYSA-N
XLogP4.13
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.48
LogP ≤ 54.13
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 2-methoxyoctanoate
CID 14952079
methyl (6S,7S,16S)-6,7,16-tris(trimethylsilyloxy)heptadecanoate
CID 162911043
Octadecanoic acid, 2-[(trimethylsilyl)oxy]-, methyl ester
CID 524479
Octadecanoic acid, 9,10-bis[(trimethylsilyl)oxy]-, methyl ester
CID 553462
Octadecanoic acid, 12-[(trimethylsilyl)oxy]-, methyl ester
CID 604384
Methyl 15-trimethylsiloxy eicosanoate
CID 129726527
Methyl 18-trimethylsiloxy eicosanoate
CID 129726555
Methyl 12-trimethylsiloxy eicosanoate
CID 129726563
Methyl 8-trimethylsiloxy eicosanoate
CID 129726572
Methyl 17-trimethylsiloxy eicosanoate
CID 129726574
Methyl 2-methoxydecanoate
CID 129725257

Frequently Asked Questions

What is the IUPAC name of methyl 2-trimethylsilyloxydecanoate?
The IUPAC name of methyl 2-trimethylsilyloxydecanoate (CID 91748926) is methyl 2-trimethylsilyloxydecanoate.
What is the SMILES notation for methyl 2-trimethylsilyloxydecanoate?
The canonical SMILES for methyl 2-trimethylsilyloxydecanoate is CCCCCCCCC(O[Si](C)(C)C)C(=O)OC.
What is the InChIKey of methyl 2-trimethylsilyloxydecanoate?
The InChIKey is OPJOOLRQPVHOBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O3Si/c1-6-7-8-9-10-11-12-13(14(15)16-2)17-18(3,4)5/h13H,6-12H2,1-5H3.
What are the key properties of methyl 2-trimethylsilyloxydecanoate?
methyl 2-trimethylsilyloxydecanoate has a molecular weight of 274.48 g/mol, XLogP of 4.13, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-trimethylsilyloxydecanoate is sourced from PubChem (CID 91748926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).