Ellagic acid
Properties
- Molecular formula
- C14H6O8
- Molar mass
- 302.19 g/mol
- Exact mass
- 302.0063 Da
- Density
- 1.667 g/mL (at 17.8 °C)
- Melting point
- above 360 °C
- Water solubility
- < 1 g/L (21.1 °C)
- logP
- 1.31Crippen estimate
- Polar surface area
- 141.3 Ų
- H-bond donors / acceptors
- 4 / 8
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation98.8% of notifiers
- H319 Causes serious eye irritation98.8% of notifiers
- H335 May cause respiratory irritation97.6% of notifiers
Aggregated from 84 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
476-66-4SMILES
O=c1oc2c(O)c(O)cc3c(=O)oc4c(O)c(O)cc1c4c23InChIKey
AFSDNFLWKVMVRB-UHFFFAOYSA-NInChI
InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
17 names · show all
- [1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 2,3,7,8-tetrahydroxy-
- 2,3,7,8-Tetrahydroxy[1]benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione
- C.I. 55005
- C.I. 75270
- Alizarine yellow
- Benzoaric acid
- Gallogen (astringent)
- [1,1′-Biphenyl]-2,2′-dicarboxylic acid, 4,4′,5,5′,6,6′-hexahydroxy-, di-δ-lactone
- Eleagic acid
- Gallogen
- Elagostasine
- Lagistase
- Alizarin yellow
- G 91006
- LDN 0097519
- Ellagic acid LT
- 2,3,7,8-Tetrahydroxy-chromeno[5,4,3-cde]chromene-5,10-dione
Work with Ellagic acid
Similar compounds
3,3′-Di-O-methylellagic acid2239-88-558 % similar
Brevifolincarboxylicacid18490-95-442 % similar
Gossypetin489-35-041 % similar
Herbacetin527-95-741 % similar
7,8-Dihydroxy-4-methylcoumarin2107-77-938 % similar
Pyromellitic dianhydride89-32-738 % similar
Daphnetin486-35-137 % similar
7,8-Dihydroxyflavone38183-03-836 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.