2'-Fluoro-2-methylamino-5-nitrobenzophenone

C₁₄H₁₁FN₂O₃CAS 735-06-8274.25 g/mol

Aryl halide Ketone Nitro Secondary amine

Properties

Molecular formula: C₁₄H₁₁FN₂O₃
Molar mass: 274.25 g/mol
Exact mass: 274.0754 Da
Melting point: 186–187 °C
logP: 3.01Crippen estimate
Polar surface area: 72.2 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 4

Hazards

Not classified as hazardous under GHS by 2 ECHA notifiers. Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number

735-06-8

SMILES

CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1F

InChIKey

GVXPKRIRHDRCGY-UHFFFAOYSA-N

InChI

InChI=1S/C14H11FN2O3/c1-16-13-7-6-9(17(19)20)8-11(13)14(18)10-4-2-3-5-12(10)15/h2-8,16H,1H3

Weigh it out

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

Names and synonyms

6 names

(2-Fluorophenyl)[2-(methylamino)-5-nitrophenyl]methanone
Methanone, (2-fluorophenyl)[2-(methylamino)-5-nitrophenyl]-
Benzophenone, 2′-fluoro-2-(methylamino)-5-nitro-
2′-Fluoro-2-methylamino-5-nitrobenzophenone
2-(Methylamino)-5-nitro-2′-fluorobenzophenone
Ro 05-5114

Work with 2'-Fluoro-2-methylamino-5-nitrobenzophenone

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

2-Amino-2'-fluoro-5-nitrobenzophenone344-80-965 % similar 2-Fluoro-N-methyl-5-nitroaniline110729-51-659 % similar 1-(2-Fluoro-5-nitrophenyl)ethan-1-one79110-05-753 % similar N1-Methyl-4-nitro-O-phenyldiamin41939-61-152 % similar 2-(2-Chloroacetamido)-5-nitro-2'-chlorobenzophenone180854-85-751 % similar Methyl 2-fluoro-5-nitrobenzoate2965-22-250 % similar 2,7-Dinitro-9-fluorenone31551-45-850 % similar 2-Fluoro-5-nitrobenzoic acid7304-32-750 % similar

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

Elsewhere

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