Homogentisic acid lactone

C8H6O3CAS 2688-48-4150.13 g/mol

OOHO
EsterLactonePhenol

Properties

Molecular formula
C8H6O3
Molar mass
150.13 g/mol
Exact mass
150.0317 Da
Melting point
240 °C (decomposes)
logP
0.85Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 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
2688-48-4
SMILES
O=C1Cc2cc(O)ccc2O1
InChIKey
POUITAHNNRJWMA-UHFFFAOYSA-N
InChI
InChI=1S/C8H6O3/c9-6-1-2-7-5(3-6)4-8(10)11-7/h1-3,9H,4H2

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Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names
  • 2(3H)-Benzofuranone, 5-hydroxy-
  • Acetic acid, (2,5-dihydroxyphenyl)-, γ-lactone
  • 5-Hydroxy-2(3H)-benzofuranone
  • Homogentisic lactone
  • 2,5-Dihydroxyphenylacetic acid lactone
  • 5-Hydroxy-2-coumaranone
  • 2,5-Dihydroxyphenylacetic acid γ-lactone
  • NSC 61996
  • 5-Hydroxy-3H-benzofuran-2-one
  • Homogentisic acid γ-lactone
  • 5-Hydroxybenzofuran-2-one

Work with Homogentisic acid lactone

Similar compounds

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

Same formula

Elsewhere