Embelin
CAS Registry Number®
550-24-3
CAS Name
EmbelinMolecular Formula
C17H26O4Molecular Mass
294.39Cite this Page
Embelin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=550-24-3 (retrieved ) (CAS RN: 550-24-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
142.5 °CDensity (2)
0.27 g/cm³
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
- (2) Patel, R. K.; Indian Journal of Pharmaceutical Sciences, (2006), 68(2), 227-230, CAplus
Other Names and Identifiers
InChI
InChI=1S/C17H26O4/c1-2-3-4-5-6-7-8-9-10-11-13-16(20)14(18)12-15(19)17(13)21/h12,18,21H,2-11H2,1H3
InChIKey
InChIKey=IRSFLDGTOHBADP-UHFFFAOYSA-N
SMILES
C(CCCCCCCCCC)C=1C(=O)C(O)=CC(=O)C1O
Canonical SMILES
O=C1C=C(O)C(=O)C(=C1O)CCCCCCCCCCC
Other Names for this Substance
- 2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3-undecyl-
- p-Benzoquinone, 2,5-dihydroxy-3-undecyl-
- Embelin
- 2,5-Dihydroxy-3-undecyl-2,5-cyclohexadiene-1,4-dione
- Embelic acid
