2-Chloro-3,5-dinitrobenzotrifluoride
Properties
- Molecular formula
- C7H2ClF3N2O4
- Molar mass
- 270.55 g/mol
- Exact mass
- 269.9655 Da
- Melting point
- 57–59 °C
- logP
- 3.18Crippen estimate
- Polar surface area
- 86.3 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation91.1% of notifiers
- H319 Causes serious eye irritation88.9% of notifiers
- H332 Harmful if inhaled11.1% of notifiers
- H335 May cause respiratory irritation86.7% of notifiers
Aggregated from 45 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, P317, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
392-95-0SMILES
O=[N+]([O-])c1cc([N+](=O)[O-])c(Cl)c(C(F)(F)F)c1InChIKey
RLXKADBMLQPLDV-UHFFFAOYSA-NInChI
InChI=1S/C7H2ClF3N2O4/c8-6-4(7(9,10)11)1-3(12(14)15)2-5(6)13(16)17/h1-2HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- Benzene, 2-chloro-1,5-dinitro-3-(trifluoromethyl)-
- Toluene, 2-chloro-α,α,α-trifluoro-3,5-dinitro-
- 2-Chloro-1,5-dinitro-3-(trifluoromethyl)benzene
- 2-Chloro-3,5-dinitro-α,α,α-trifluorotoluene
- 2-Chloro-α,α,α-trifluoro-3,5-dinitrotoluene
- 1-Chloro-2,4-dinitro-6-(trifluoromethyl)benzene
Work with 2-Chloro-3,5-dinitrobenzotrifluoride
Similar compounds
2,4-Dichloro-3,5-dinitrobenzotrifluoride29091-09-668 % similar
Picryl chloride88-88-067 % similar
2-Chloro-1-nitro-3-(trifluoromethyl)benzene39974-35-163 % similar
2,3-Dichloro-4-trifluoromethyl-6-nitrotoluene115571-67-061 % similar
2,3-Dichloro-4-methyl-1-nitro-5-(trifluoromethyl)benzene115571-68-161 % similar
2-Chloro-5-nitrobenzotrifluoride777-37-757 % similar
2-Chloro-4-nitro-6-(trifluoromethyl)benzenamine400-67-957 % similar
4,5-Dichloro-2-nitrobenzotrifluoride50594-31-556 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.