3-(1,1,2,2-Tetrafluoroethoxy)benzenamine

C8H7F4NOCAS 831-75-4209.14 g/mol

Open in Covalent MOL file
NH2OFFFF
Alkyl halideEtherPrimary amine

Properties

Molecular formula
C8H7F4NO
Molar mass
209.14 g/mol
Exact mass
209.0464 Da
logP
2.51Crippen estimate
Polar surface area
35.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 42 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, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
831-75-4
SMILES
Nc1cccc(OC(F)(F)C(F)F)c1
InChIKey
MWDPEBMCVXNSPL-UHFFFAOYSA-N
InChI
InChI=1S/C8H7F4NO/c9-7(10)8(11,12)14-6-3-1-2-5(13)4-6/h1-4,7H,13H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names
  • Benzenamine, 3-(1,1,2,2-tetrafluoroethoxy)-
  • m-Phenetidine, α,α,β,β-tetrafluoro-
  • 3-(1,1,2,2-Tetrafluoroethoxy)aniline
  • m-(1,1,2,2-Tetrafluoroethoxy)aniline

Work with 3-(1,1,2,2-Tetrafluoroethoxy)benzenamine

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

3-(Trifluoromethoxy)aniline1535-73-564 % similar 1-Methyl-3-(1,1,2,2-tetrafluoroethoxy)benzene1737-10-661 % similar (1,1,2,2-Tetrafluoroethoxy)benzene350-57-259 % similar 3-(1,1,2,2-Tetrafluoroethoxy)benzaldehyde35295-35-356 % similar 3-(Difluoromethoxy)aniline22236-08-454 % similar 3-(1,1,2,2-Tetrafluoroethoxy)benzoic acid70126-48-652 % similar 3,3′-Oxydianiline15268-07-250 % similar M-Anisidine536-90-350 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-(1,1,2,2-Tetrafluoroethoxy)aniline713-62-2

Elsewhere

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