2-Furoylacetonitrile
Properties
- Molecular formula
- C7H5NO2
- Molar mass
- 135.12 g/mol
- Exact mass
- 135.0320 Da
- logP
- 1.38Crippen estimate
- Polar surface area
- 54.0 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin91.1% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled91.1% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
31909-58-7SMILES
C1=COC(=C1)C(=O)CC#NInChIKey
RZNSHBXVTAHWPP-UHFFFAOYSA-NInChI
InChI=1S/C7H5NO2/c8-4-3-6(9)7-2-1-5-10-7/h1-2,5H,3H2Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 2-Furoylacetonitrile
Similar compounds
Benzoylacetonitrile614-16-455 % similar
1-(2-Furanyl)-1,3-butanedione25790-35-651 % similar
3-(2-Fluorophenyl)-3-oxopropionitrile31915-26-151 % similar
2-Chloro-β-oxobenzenepropanenitrile40018-25-551 % similar
2-Hexanoylfuran14360-50-049 % similar
2-Thenoylacetonitrile33898-90-749 % similar
4,4,4-Trifluoro-1-(2-furanyl)-1,3-butanedione326-90-948 % similar
β-Oxo-2-pyridinepropanenitrile54123-21-647 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds