chempirical

2-Fluoro-4-methylaniline

C7H8FNCAS 452-80-2125.15 g/mol

Open in Covalent MOL file
NH2F
Aryl halidePrimary amine

Properties

Molecular formula
C7H8FN
Molar mass
125.15 g/mol
Exact mass
125.0641 Da
Density
1.1084 g/mL (at 18 °C)
Melting point
3.2–3.5 °C
Boiling point
70–71 °C (at 7 Torr)
logP
1.72Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
452-80-2
SMILES
Cc1ccc(N)c(F)c1
InChIKey
ZQEXBVHABAJPHJ-UHFFFAOYSA-N
InChI
InChI=1S/C7H8FN/c1-5-2-3-7(9)6(8)4-5/h2-4H,9H2,1H3

Weigh it out

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

Names and synonyms

8 names
  • Benzenamine, 2-fluoro-4-methyl-
  • p-Toluidine, 2-fluoro-
  • 2-Fluoro-4-methylbenzenamine
  • 2-Fluoro-p-toluidine
  • 4-Amino-3-fluorotoluene
  • 4-Methyl-2-fluoroaniline
  • (2-Fluoro-4-methylphenyl)amine
  • NSC 147489

Work with 2-Fluoro-4-methylaniline

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-Fluoro-5-methylaniline452-84-669 % similar 3,4-Diaminotoluene496-72-060 % similar 2,4-Difluoroaniline367-25-956 % similar 2,4-Xylidine95-68-156 % similar 2-Chloro-4-methylaniline615-65-654 % similar 2-Amino-5-methylphenol2835-98-552 % similar 2-Iodo-4-methylaniline29289-13-252 % similar 2-Fluoro-4-iodoaniline29632-74-452 % similar

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

Same formula

3-Fluorobenzylamine100-82-3 4-Fluorobenzylamine140-75-0 2-Fluoro-N-methylbenzenamine1978-38-7 5-Fluoro-2-methylaniline367-29-3 3-Fluoro-2-methylaniline443-86-7 4-Fluoro-3-methylaniline452-69-7 4-Fluoro-2-methylaniline452-71-1 3-Fluoro-4-methylaniline452-77-7

Elsewhere

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