2,2,3,3-Tetrafluoro-1,4-benzodioxin-6-amine

C₈H₅F₄NO₂CAS 89586-07-2223.13 g/mol

Open in Covalent MOL file

Alkyl halide Ether Primary 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 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

89586-07-2

SMILES

C1=CC2=C(C=C1N)OC(C(O2)(F)F)(F)F

InChIKey

DCMDRNWAGHTMTR-UHFFFAOYSA-N

InChI

InChI=1S/C8H5F4NO2/c9-7(10)8(11,12)15-6-3-4(13)1-2-5(6)14-7/h1-3H,13H2

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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

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

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 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 Benzodioxol-5-amine14268-66-745 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,2,4,4-Tetrafluoro-4H-benzo[d][1,3]dioxin-6-amine25854-59-5

Elsewhere

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