chempirical

1,8,9-Anthracenetriol

C14H10O3CAS 480-22-8226.23 g/mol

Open in Covalent MOL file
OHOHOH
Phenol

Properties

Molecular formula
C14H10O3
Molar mass
226.23 g/mol
Exact mass
226.0630 Da
Water solubility
< 1 g/L (17.2 °C)
logP
3.11Crippen estimate
Polar surface area
60.7 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
480-22-8
SMILES
Oc1cccc2cc3cccc(O)c3c(O)c12
InChIKey
YUTJCNNFTOIOGT-UHFFFAOYSA-N
InChI
InChI=1S/C14H10O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1-7,15-17H

Weigh it out

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Names and synonyms

5 names
  • 1,8,9-Anthratriol
  • 1,8-Dihydroxy-9-anthranol
  • 1,8,9-Trihydroxyanthracene
  • 1,8-Dihydroxyanthranol
  • NSC 403736

Work with 1,8,9-Anthracenetriol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,8-Dihydroxynaphthalene569-42-661 % similar Pyrogallol87-66-152 % similar 1-Naphthol90-15-346 % similar 2,3-Dihydroxynaphthalene92-44-444 % similar 3-Bromobenzene-1,2-diol14381-51-243 % similar Anthracene-1,4,9,10-tetraol476-60-843 % similar 1,7-Dihydroxynaphthalene575-38-242 % similar 1,6-Dihydroxynaphthalene575-44-042 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Dithranol1143-38-0 Flurenol467-69-6 5-Phenoxy-1(3H)-isobenzofuranone57830-14-5 3-Benzoylbenzoic acid579-18-0 4-Benzoylbenzoic acid611-95-0 Xanthene-9-carboxylic acid82-07-5 2-Benzoylbenzoic acid85-52-9 Benzoic anhydride93-97-0

Elsewhere

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