10-[tert-butyl(dimethyl)silyl]oxydecanoic acid

C16H34O3Si — CID 11141194

IUPAC10-[tert-butyl(dimethyl)silyl]oxydecanoic acid
SMILESCC(C)(C)[Si](C)(C)OCCCCCCCCCC(=O)O
InChIInChI=1S/C16H34O3Si/c1-16(2,3)20(4,5)19-14-12-10-8-6-7-9-11-13-15(17)18/h6-14H2,1-5H3,(H,17,18)
InChIKeyLKCBRMCZEHRAAD-UHFFFAOYSA-N
MW302.53 g/mol
LogP5.21
Rot. Bonds11

About 10-[tert-butyl(dimethyl)silyl]oxydecanoic acid

10-[tert-butyl(dimethyl)silyl]oxydecanoic acid (PubChem CID 11141194) has the molecular formula C16H34O3Si and a molecular weight of 302.53 g/mol. Its IUPAC name is 10-[tert-butyl(dimethyl)silyl]oxydecanoic acid.

Molecular Properties

Compound Name10-[tert-butyl(dimethyl)silyl]oxydecanoic acid
PubChem CID11141194
Molecular FormulaC16H34O3Si
Molecular Weight302.53 g/mol
Exact Mass302.23
IUPAC Name10-[tert-butyl(dimethyl)silyl]oxydecanoic acid
SMILESCC(C)(C)[Si](C)(C)OCCCCCCCCCC(=O)O
InChIInChI=1S/C16H34O3Si/c1-16(2,3)20(4,5)19-14-12-10-8-6-7-9-11-13-15(17)18/h6-14H2,1-5H3,(H,17,18)
InChIKeyLKCBRMCZEHRAAD-UHFFFAOYSA-N
XLogP5.21
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.53
LogP ≤ 55.21
H-Bond Donors ≤ 51
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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Related Compounds

Trimethylsilyl stearate
CID 87777
Npc119807
CID 519592
Hexadecanic acid, trimethylsilyl ester
CID 521638
6-[(Tert-butyldimethylsilyl)oxy]hexanoic acid
CID 12717311
Trimethylsilyl tridecanoate
CID 519342
n-Pentanoic acid, trimethylsilyl ester
CID 523679
Trimethylsilyl tetracosanoate
CID 522540
Methyl 16-[(trimethylsilyl)oxy]hexadecanoate
CID 554929
Trimethylsilyl heptadecanoate
CID 521635
Arachidic acid, trimethylsilyl ester
CID 521648
Trimethylsilyl nonadecanoate
CID 522538
Trimethylsilyl docosanoate
CID 522539

Frequently Asked Questions

What is the IUPAC name of 10-[tert-butyl(dimethyl)silyl]oxydecanoic acid?
The IUPAC name of 10-[tert-butyl(dimethyl)silyl]oxydecanoic acid (CID 11141194) is 10-[tert-butyl(dimethyl)silyl]oxydecanoic acid.
What is the SMILES notation for 10-[tert-butyl(dimethyl)silyl]oxydecanoic acid?
The canonical SMILES for 10-[tert-butyl(dimethyl)silyl]oxydecanoic acid is CC(C)(C)[Si](C)(C)OCCCCCCCCCC(=O)O.
What is the InChIKey of 10-[tert-butyl(dimethyl)silyl]oxydecanoic acid?
The InChIKey is LKCBRMCZEHRAAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O3Si/c1-16(2,3)20(4,5)19-14-12-10-8-6-7-9-11-13-15(17)18/h6-14H2,1-5H3,(H,17,18).
What are the key properties of 10-[tert-butyl(dimethyl)silyl]oxydecanoic acid?
10-[tert-butyl(dimethyl)silyl]oxydecanoic acid has a molecular weight of 302.53 g/mol, XLogP of 5.21, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[tert-butyl(dimethyl)silyl]oxydecanoic acid is sourced from PubChem (CID 11141194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).