Chemical Properties of Isoxazolium compounds: 2-ethyl-5-(m-sulfophenyl)-hydroxide, inner salt

Isoxazolium compounds: 2-ethyl-5-(m-sulfophenyl)-hydroxide, inner salt

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InChI
InChI=1S/C11H11NO4S/c1-2-12-7-10(8-16-12)9-4-3-5-11(6-9)17(13,14)15/h3-8H,2H2,1H3
InChI Key
VRTQQJBZFOSHCJ-UHFFFAOYSA-N
Formula
C11H11NO4S
SMILES
CC[n+]1cc(-c2cccc(S(=O)(=O)[O-])c2)co1
Molecular Weight1
253.27
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Physical Properties

Property Value Unit Source
log10WS -9.42 Crippen Calculated Property
logPoct/wat 1.158 Crippen Calculated Property
McVol 172.440 ml/mol McGowan Calculated Property

Similar Compounds

Thymidine, 3'-O-acetyl, 5'-O-TBDMS. Glyceollin III, TMS. Tinctorine. Glyceollin V, TMS. N-Desmethylmirtazapine. Sophoramine. Mirtazapine-M (oxo-). Mirtazapine. Cytosine arabinoside, dimethyl-TMS derivative. Nalmefene, trimethylsilyl ether. Ajmaline. Galantamin. 3-propionyl-morphine. Brucine. TCN.

Find more compounds similar to Isoxazolium compounds: 2-ethyl-5-(m-sulfophenyl)-hydroxide, inner salt.

Sources

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