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Home >> Chemical Listing >> Page 2809 >> 1-(1,3-Benzothiazol-2-yl)-1,3-butanedione

1-(1,3-Benzothiazol-2-yl)-1,3-butanedione
[CAS# 86319-88-2]

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Identification
Name 1-(1,3-Benzothiazol-2-yl)-1,3-butanedione
Synonyms 1-(benzo[d]thiazol-2-yl)butane-1,3-dione
Molecular Structure CAS#: 86319-88-2, 1-(1,3-Benzothiazol-2-yl)-1,3-butanedione
Molecular Formula C11H9NO2S
Molecular Weight 219.26
CAS Registry Number 86319-88-2
SMILES CC(=O)CC(=O)c1nc2ccccc2s1
InChI 1S/C11H9NO2S/c1-7(13)6-9(14)11-12-8-4-2-3-5-10(8)15-11/h2-5H,6H2,1H3
InChIKey GLBHDSPTUZOETI-UHFFFAOYSA-N
Properties
Density 1.306g/cm3 (Cal.)
Boiling point 368.755°C at 760 mmHg (Cal.)
Flash point 176.817°C (Cal.)
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