CAS Registry Number®
518-82-1
CAS Name
Emodin
Molecular Formula
C15H10O5
Molecular Mass
270.24
Compound Properties
-
Boiling Point (1)
60-80 °C
-
Melting Point (2)
256-257 °C
Source(s)
- (1) Khan, Abu T.; Synthesis, (1994), (3), 255-7, CAplus
- (2) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3
InChIKey
InChIKey=RHMXXJGYXNZAPX-UHFFFAOYSA-N
SMILES
O=C1C=2C(C(=O)C=3C1=C(O)C=C(O)C3)=CC(C)=CC2O
Canonical SMILES
O=C1C=2C=C(O)C=C(O)C2C(=O)C3=C(O)C=C(C=C13)C
Other Names for this Substance
- 9,10-Anthracenedione, 1,3,8-trihydroxy-6-methyl-
- Anthraquinone, 1,3,8-trihydroxy-6-methyl-
- 1,3,8-Trihydroxy-6-methyl-9,10-anthracenedione
- Emodin
- 3-Methyl-1,6,8-trihydroxyanthraquinone
- Rheum emodin
- Schuttgelb
- 4,5,7-Trihydroxy-2-methylanthraquinone
- 1,3,8-Trihydroxy-6-methylanthraquinone
- Frangula emodin
- Emodol
- 1,3,8-Trihydroxy-6-methyl-9,10-anthraquinone
- 1,6,8-Trihydroxy-3-methylanthraquinone
- Frangulic acid
- Archin
- NSC 408120
- NSC 622947
- Emodine
- 1,3,8-Trihydroxy-6-methyl-9,10-dihydroanthracene-9,10-dione
- 1,8-Dihydroxy-3-(methoxymethyl)-6-methylanthracene-9,10-dione
- MeSH ID: D004642
Deleted or Replaced CAS Registry Numbers
2375546-29-3
