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CAS Number: 1214-24-0
3,6-dihydroxy-9H-xanthen-9-one

Structure

3,6-dihydroxy-9H-xanthen-9-one
Name: 3,6-dihydroxy-9H-xanthen-9-one
Synonyms:
General Information
Product Number: 1214240

CAS Registry Number 1214-24-0
Name:
9H-​Xanthen-​9-​one, 3,​6-​dihydroxy-
Xanthen-9-one, 3,6-dihydroxy- (7CI,8CI)
3,6-Dihydroxy-9H-xanthen-9-one
3,6-Dihydroxyxanthen-9-one
3,6-Dihydroxyxanthone

 

Chemical Formula: C13H8O4
Exact Mass: 228.04
Molecular Weight: 228.20
m/z: 228.04 (100.0%), 229.05 (14.3%), 230.05 (1.8%)

 

InChI:InChI=1S/C13H8O4/c14-7-1-3-9-11(5-7)17-12-6-8(15)2-4-10(12)13(9)16/h1-6,14-15H

InChI Key:POARTHFLPKAZBQ-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1O)OC3=C(C2=O)C=CC(=C3)O

 

Thermal Properties Value Condition Note
Melting Point >330 °C   (2)CAS
Melting Point 320 °C Solv: ethanol (64-17-5); water (7732-18-5) (3)IC
Melting Point >300 °C   (4)IC

Specification

98%

References
  1. (2) Grover, P. K.; Journal of the Chemical Society 1955, P3982-5 CAPLUS
  2. (3) Patel, G. N.; Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry 1987, V26B(11), P1035-8 CAPLUS
  3. (4) Carr, Albert A.; Journal of Medicinal Chemistry 1976, V19(9), P1142-8 CAPLUS
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