2,2-Bis(3-aminophenyl)hexafluoropropane

C₁₅H₁₂F₆N₂CAS 47250-53-3334.27 g/mol

Open in Covalent MOL file

Alkyl halide Primary amine

Properties

Molecular formula: C₁₅H₁₂F₆N₂
Molar mass: 334.27 g/mol
Exact mass: 334.0905 Da
logP: 4.26Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

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

47250-53-3

SMILES

C1=CC(=CC(=C1)N)C(C2=CC(=CC=C2)N)(C(F)(F)F)C(F)(F)F

InChIKey

UVUCUHVQYAPMEU-UHFFFAOYSA-N

InChI

InChI=1S/C15H12F6N2/c16-14(17,18)13(15(19,20)21,9-3-1-5-11(22)7-9)10-4-2-6-12(23)8-10/h1-8H,22-23H2

Weigh it out

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Work with 2,2-Bis(3-aminophenyl)hexafluoropropane

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-(Trifluoromethyl)aniline98-16-864 % similar 3-(1,1-Dimethylethyl)benzenamine5369-19-753 % similar M-Phenylenediamine108-45-248 % similar 4,4′-[[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]bis(4,1-phenyleneoxy)]bis[benzenamine]69563-88-847 % similar 2,2-Bis(3-amino-4-methylphenyl)hexafluoropropane116325-74-746 % similar 2,2′-Bis(3-amino-4-hydroxyphenyl)hexafluoropropane83558-87-646 % similar 3-[(Trifluoromethyl)thio]benzenamine369-68-645 % similar 3-Fluoroaniline372-19-045 % similar

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

Same formula

4,4'-(Hexafluoroisopropylidene)dianiline1095-78-9

Elsewhere

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