chempirical

4-Iodo-2-methylaniline

C7H8INCAS 13194-68-8233.05 g/mol

Open in Covalent MOL file
IH2N
Aryl halidePrimary amine

Properties

Molecular formula
C7H8IN
Molar mass
233.05 g/mol
Exact mass
232.9701 Da
Melting point
88 °C
logP
2.18Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
13194-68-8
SMILES
Cc1cc(I)ccc1N
InChIKey
BGKLFAQCHHCZRZ-UHFFFAOYSA-N
InChI
InChI=1S/C7H8IN/c1-5-4-6(8)2-3-7(5)9/h2-4H,9H2,1H3

Weigh it out

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

Names and synonyms

7 names
  • Benzenamine, 4-iodo-2-methyl-
  • o-Toluidine, 4-iodo-
  • 4-Iodo-2-methylbenzenamine
  • 4-Iodo-o-toluidine
  • 2-Amino-5-iodotoluene
  • NSC 60731
  • 2-Methyl-4-iodoaniline

Work with 4-Iodo-2-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

Tolidine119-93-760 % similar 1-Iodo-3,4-dimethylbenzene31599-61-858 % similar 2,4-Diiodobenzenamine533-70-058 % similar 2,4-Xylidine95-68-158 % similar 2,5-Diaminotoluene95-70-558 % similar 4-Chloro-O-toluidine95-69-256 % similar 4-Amino-3-methylphenol2835-99-654 % similar 2-Fluoro-4-iodoaniline29632-74-454 % similar

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

Same formula

2-Iodo-5-methylbenzenamine13194-69-9 2-Iodo-4-methylaniline29289-13-2 3-Iodo-4-methylbenzenamine35944-64-0 4-Iodobenzylamine39959-59-6 3-Iodobenzylamine696-40-2 5-Iodo-2-methylaniline83863-33-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook