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Isogentisin
[CAS# 491-64-5]

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Identification
Name Isogentisin
Synonyms 1,3-Dihydroxy-7-Methoxy-Xanthen-9-One; 1,3-Dihydroxy-7-Methoxy-9-Xanthenone; 1,3-Dihydroxy-7-Methoxy-Xanthone
Molecular Structure CAS#: 491-64-5, Isogentisin
Molecular Formula C14H10O5
Molecular Weight 258.23
CAS Registry Number 491-64-5
SMILES C1=C(O)C=C(C2=C1OC3=C(C2=O)C=C(OC)C=C3)O
InChI 1S/C14H10O5/c1-18-8-2-3-11-9(6-8)14(17)13-10(16)4-7(15)5-12(13)19-11/h2-6,15-16H,1H3
InChIKey FVIYCYAHKMJVJK-UHFFFAOYSA-N
Properties
Density 1.48g/cm3 (Cal.)
Boiling point 519.358°C at 760 mmHg (Cal.)
Flash point 204.99°C (Cal.)
Safety Data
SDS Available
References
(1) Ivana Radosavljevic Evans, Judith A. K. Howard, Katarina Savikin-Fodulovic and Nebojsa Menkovic . Isogentisin (1,3-dihydroxy-7-methoxyxanthone) , Acta Cryst (2004). E60, o1557-o1559   
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