Tropolone
Properties
- Molecular formula
- C7H6O2
- Molar mass
- 122.12 g/mol
- Exact mass
- 122.0368 Da
- Melting point
- 50.8 °C
- Boiling point
- 67–73 °C (at NaN Torr)
- logP
- 0.75Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 0
Hazards
Danger
- H314 Causes severe skin burns and eye damage85% of notifiers
- H317 May cause an allergic skin reaction85% of notifiers
- H318 Causes serious eye damage85% of notifiers
- H400 Very toxic to aquatic life85% of notifiers
- H410 Very toxic to aquatic life with long lasting effects85% of notifiers
Aggregated from 20 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P264, P264+P265, P272, P273, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P333+P317, P362+P364, P363, P391, P405, P501
Identifiers
CAS number
533-75-5SMILES
O=c1cccccc1OInChIKey
MDYOLVRUBBJPFM-UHFFFAOYSA-NInChI
InChI=1S/C7H6O2/c8-6-4-2-1-3-5-7(6)9/h1-5H,(H,8,9)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 2,4,6-Cycloheptatrien-1-one, 2-hydroxy-
- 2-Hydroxy-2,4,6-cycloheptatrien-1-one
- Purpurocatechol
- 2-Hydroxytropone
- α-Tropolone
- NSC 89303
- 2-Hydroxycyclohepta-2,4,6-trienone
Reactions
Work with Tropolone
Similar compounds
Catechol120-80-953 % similar
(1,1'-Biphenyl)-2,2'-diol1806-29-745 % similar
Hinokitiol499-44-545 % similar
3-Hydroxy-4-pyrone496-63-944 % similar
(1,1'-Biphenyl)-2-ol90-43-744 % similar
5-Hydroxyflavone491-78-142 % similar
2-Bromophenol95-56-742 % similar
2,2′-Dihydroxybenzophenone835-11-041 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds