1-(2-Furanyl)-1,3-butanedione
Properties
- Molecular formula
- C8H8O3
- Molar mass
- 152.15 g/mol
- Exact mass
- 152.0473 Da
- Boiling point
- 110–115 °C (at 15 Torr)
- logP
- 1.44Crippen estimate
- Polar surface area
- 47.3 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 3
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 4 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
25790-35-6SMILES
CC(=O)CC(=O)c1ccco1InChIKey
GPYKJDYMMUIUFG-UHFFFAOYSA-NInChI
InChI=1S/C8H8O3/c1-6(9)5-7(10)8-3-2-4-11-8/h2-4H,5H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- 1,3-Butanedione, 1-(2-furanyl)-
- 1,3-Butanedione, 1-(2-furyl)-
- 2-Furoylacetone
- 1-(2-Furyl)-1,3-butanedione
- 2-(1,3-Dioxobutyl)furan
- 1-(Furan-2-yl)-1,3-dioxobutane
Work with 1-(2-Furanyl)-1,3-butanedione
Similar compounds
Ethyl 3-(2-furyl)-3-oxopropanoate615-09-856 % similar
4,4,4-Trifluoro-1-(2-furanyl)-1,3-butanedione326-90-955 % similar
Benzoylacetone93-91-453 % similar
2-Hexanoylfuran14360-50-053 % similar
2-Acetylfuran1192-62-752 % similar
2-Furoylacetonitrile31909-58-751 % similar
2-Furoic acid88-14-247 % similar
Alpha-furil492-94-447 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.