14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid

C17H34O4Si — CID 161078505

IUPAC14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid
SMILESCO[Si](C)(C)CCCCCCCCCCC(=O)CCC(=O)O
InChIInChI=1S/C17H34O4Si/c1-21-22(2,3)15-11-9-7-5-4-6-8-10-12-16(18)13-14-17(19)20/h4-15H2,1-3H3,(H,19,20)
InChIKeyNVNAVEGDDFSDPX-UHFFFAOYSA-N
MW330.54 g/mol
LogP4.78
Rot. Bonds15

About 14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid

14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid (PubChem CID 161078505) has the molecular formula C17H34O4Si and a molecular weight of 330.54 g/mol. Its IUPAC name is 14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid.

Molecular Properties

Compound Name14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid
PubChem CID161078505
Molecular FormulaC17H34O4Si
Molecular Weight330.54 g/mol
Exact Mass330.22
IUPAC Name14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid
SMILESCO[Si](C)(C)CCCCCCCCCCC(=O)CCC(=O)O
InChIInChI=1S/C17H34O4Si/c1-21-22(2,3)15-11-9-7-5-4-6-8-10-12-16(18)13-14-17(19)20/h4-15H2,1-3H3,(H,19,20)
InChIKeyNVNAVEGDDFSDPX-UHFFFAOYSA-N
XLogP4.78
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.54
LogP ≤ 54.78
H-Bond Donors ≤ 51
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

CID 59616608
CID 59616608
1,3-Bis(10-carboxydecyl) tetramethyldisiloxane
CID 3732578
11-Triethoxysilylundecanoic acid
CID 22725829
Dodecandioic acid, tert-butyldimethylsilyl ester
CID 91697366
16-Trimethylsilylhexadecanoic acid
CID 91087067
15-Trimethylsiloxypentadecanoic acid
CID 129810824
Trimethylsilyl 10-ketostearic acid
CID 129853162
12-Hydroxystearic acid, mono-TBDMS
CID 91752554
10-[Tert-butyl(dimethyl)silyl]oxydecanoic acid
CID 11141194
3-Oxo-1,8-octanedicarboxylic acid, bis(trimethylsilyl) ester
CID 91696403
3-Oxo-1,8-octanedicarboxylic acid, bis(tert-butyldimethylsilyl) ester
CID 91697216
Dodecanoic acid, 12-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-
CID 9996773

Frequently Asked Questions

What is the IUPAC name of 14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid?
The IUPAC name of 14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid (CID 161078505) is 14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid.
What is the SMILES notation for 14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid?
The canonical SMILES for 14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid is CO[Si](C)(C)CCCCCCCCCCC(=O)CCC(=O)O.
What is the InChIKey of 14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid?
The InChIKey is NVNAVEGDDFSDPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O4Si/c1-21-22(2,3)15-11-9-7-5-4-6-8-10-12-16(18)13-14-17(19)20/h4-15H2,1-3H3,(H,19,20).
What are the key properties of 14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid?
14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid has a molecular weight of 330.54 g/mol, XLogP of 4.78, 15 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 14-[methoxy(dimethyl)silyl]-4-oxotetradecanoic acid is sourced from PubChem (CID 161078505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).