ethyl 2-fluoro-2-triethylsilylacetate

C10H21FO2Si — CID 174297948

IUPACethyl 2-fluoro-2-triethylsilylacetate
SMILESCCOC(=O)C(F)[Si](CC)(CC)CC
InChIInChI=1S/C10H21FO2Si/c1-5-13-10(12)9(11)14(6-2,7-3)8-4/h9H,5-8H2,1-4H3
InChIKeyWRGJLDKYLSBGKI-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.94
Rot. Bonds6

About ethyl 2-fluoro-2-triethylsilylacetate

ethyl 2-fluoro-2-triethylsilylacetate (PubChem CID 174297948) has the molecular formula C10H21FO2Si and a molecular weight of 220.36 g/mol. Its IUPAC name is ethyl 2-fluoro-2-triethylsilylacetate.

Molecular Properties

Compound Nameethyl 2-fluoro-2-triethylsilylacetate
PubChem CID174297948
Molecular FormulaC10H21FO2Si
Molecular Weight220.36 g/mol
Exact Mass220.13
IUPAC Nameethyl 2-fluoro-2-triethylsilylacetate
SMILESCCOC(=O)C(F)[Si](CC)(CC)CC
InChIInChI=1S/C10H21FO2Si/c1-5-13-10(12)9(11)14(6-2,7-3)8-4/h9H,5-8H2,1-4H3
InChIKeyWRGJLDKYLSBGKI-UHFFFAOYSA-N
XLogP2.94
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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diethyl (2R)-2-fluoro-3-oxobutanedioate
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ethyl (2S)-2-fluoro-3-hydroxy-3-methylbutanoate
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Frequently Asked Questions

What is the IUPAC name of ethyl 2-fluoro-2-triethylsilylacetate?
The IUPAC name of ethyl 2-fluoro-2-triethylsilylacetate (CID 174297948) is ethyl 2-fluoro-2-triethylsilylacetate.
What is the SMILES notation for ethyl 2-fluoro-2-triethylsilylacetate?
The canonical SMILES for ethyl 2-fluoro-2-triethylsilylacetate is CCOC(=O)C(F)[Si](CC)(CC)CC.
What is the InChIKey of ethyl 2-fluoro-2-triethylsilylacetate?
The InChIKey is WRGJLDKYLSBGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21FO2Si/c1-5-13-10(12)9(11)14(6-2,7-3)8-4/h9H,5-8H2,1-4H3.
What are the key properties of ethyl 2-fluoro-2-triethylsilylacetate?
ethyl 2-fluoro-2-triethylsilylacetate has a molecular weight of 220.36 g/mol, XLogP of 2.94, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-fluoro-2-triethylsilylacetate is sourced from PubChem (CID 174297948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).