2,2,3,3-Tetrafluoro-1,4-benzodioxin-6-amine
Properties
- Molecular formula
- C8H5F4NO2
- Molar mass
- 223.13 g/mol
- Exact mass
- 223.0256 Da
- logP
- 2.23Crippen estimate
- Polar surface area
- 44.5 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 0
Hazards
Danger
- H301 Toxic if swallowed100% of notifiers
- H311 Toxic in contact with skin100% of notifiers
- H315 Causes skin irritation50% of notifiers
- H319 Causes serious eye irritation50% of notifiers
- H331 Toxic if inhaled100% of notifiers
- H335 May cause respiratory irritation50% of notifiers
Aggregated from 2 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
89586-07-2SMILES
C1=CC2=C(C=C1N)OC(C(O2)(F)F)(F)FInChIKey
DCMDRNWAGHTMTR-UHFFFAOYSA-NInChI
InChI=1S/C8H5F4NO2/c9-7(10)8(11,12)15-6-3-4(13)1-2-5(6)14-7/h1-3H,13H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 6-Amino-2,2,3,3-tetrafluoro-1,4-benzodioxan
Work with 2,2,3,3-Tetrafluoro-1,4-benzodioxin-6-amine
Similar compounds
5-Amino-2,2-difluoro-1,3-benzodioxole1544-85-071 % similar
6-Hydroxy-2,2,3,3-tetrafluoro-1,4-benzodioxane103467-50-155 % similar
6-Bromo-2,2,3,3-tetrafluoro-1,4-benzodioxan141872-90-455 % similar
2,2,3,3-Tetrafluoro-2,3-dihydro-1,4-benzodioxine94767-47-252 % similar
3-Fluoro-4-(trifluoromethoxy)aniline1017779-69-952 % similar
3-Bromo-4-(trifluoromethoxy)aniline191602-54-749 % similar
3-Chloro-4-(trifluoromethoxy)aniline64628-73-549 % similar
4,4'-Oxybis[3-(trifluoromethyl)aniline]344-48-948 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.