2,6-Difluoro-3-nitrobenzonitrile
Properties
- Molecular formula
- C7H2F2N2O2
- Molar mass
- 184.10 g/mol
- Exact mass
- 184.0084 Da
- logP
- 1.74Crippen estimate
- Polar surface area
- 66.9 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 1
Hazards
Danger
- H301+H311+H331 Toxic if swallowed, in contact with skin or if inhaled33.3% of notifiers
- H301 Toxic if swallowed100% of notifiers
- H311 Toxic in contact with skin100% of notifiers
- H315 Causes skin irritation66.7% of notifiers
- H319 Causes serious eye irritation66.7% of notifiers
- H331 Toxic if inhaled100% of notifiers
- H335 May cause respiratory irritation33.3% of notifiers
Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
143879-77-0SMILES
C1=CC(=C(C(=C1[N+](=O)[O-])F)C#N)FInChIKey
JQHDRFKDZHGEBQ-UHFFFAOYSA-NInChI
InChI=1S/C7H2F2N2O2/c8-5-1-2-6(11(12)13)7(9)4(5)3-10/h1-2HWeigh it out
Type any one amount. The others follow from the molar mass.
Work with 2,6-Difluoro-3-nitrobenzonitrile
Similar compounds
1,2,3-Trifluoro-4-nitrobenzene771-69-763 % similar
4-Fluoro-3-nitrobenzonitrile1009-35-457 % similar
3-Fluoro-4-nitrobenzonitrile218632-01-057 % similar
2-Chloro-1,3-difluoro-4-nitrobenzene3847-58-356 % similar
1,3-Difluoro-2-methyl-4-nitrobenzene79562-49-556 % similar
2,3,6-Trifluorobenzonitrile136514-17-556 % similar
2,6-Dinitrobenzonitrile35213-00-454 % similar
1,2-Difluoro-3-nitrobenzene6921-22-854 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.