ChemicalBook--->CAS DataBase List--->887360-48-7

887360-48-7

887360-48-7 Structure

887360-48-7 Structure
IdentificationBack Directory
[Name]

AKOS BBS-00005954
[CAS]

887360-48-7
[Synonyms]

AKOS BBS-00005954
UKRORGSYN-BB BBV-028648
5-(4-ETHOXYPHENYL)-3-ISOXAZOLECARBOXYLIC ACID
3-Isoxazolecarboxylic acid, 5-(4-ethoxyphenyl)-
5-(4-ethoxyphenyl)-1,2-oxazole-3-carboxylic acid
[Molecular Formula]

C12H11NO4
[MDL Number]

MFCD07403667
[MOL File]

887360-48-7.mol
[Molecular Weight]

233.22
Chemical PropertiesBack Directory
[Boiling point ]

463.8±40.0 °C(Predicted)
[density ]

1.269±0.06 g/cm3(Predicted)
[form ]

solid
[pka]

3.34±0.10(Predicted)
[InChI]

1S/C12H11NO4/c1-2-16-9-5-3-8(4-6-9)11-7-10(12(14)15)13-17-11/h3-7H,2H2,1H3,(H,14,15)
[InChIKey]

FTVWKNMSWDXJCY-UHFFFAOYSA-N
[SMILES]

O=C(O)C1=NOC(C2=CC=C(OCC)C=C2)=C1
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
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