chempirical

2-Iodoaniline

C6H6INCAS 615-43-0219.03 g/mol

Open in Covalent MOL file
H2NI
Aryl halidePrimary amine

Properties

Molecular formula
C6H6IN
Molar mass
219.03 g/mol
Exact mass
218.9545 Da
Melting point
56.5 °C
logP
1.87Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
615-43-0
SMILES
Nc1ccccc1I
InChIKey
UBPDKIDWEADHPP-UHFFFAOYSA-N
InChI
InChI=1S/C6H6IN/c7-5-3-1-2-4-6(5)8/h1-4H,8H2

Weigh it out

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

Names and synonyms

10 names
  • Benzenamine, 2-iodo-
  • Aniline, o-iodo-
  • 2-Iodobenzenamine
  • o-Aminoiodobenzene
  • o-Iodoaniline
  • 2-Aminophenyl iodide
  • NSC 34544
  • 1-Amino-2-iodobenzene
  • 2-Iodophenylamine
  • 2-Aminoiodobenzene

Work with 2-Iodoaniline

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

1,2-Diiodobenzene615-42-956 % similar O-Phenylenediamine95-54-556 % similar 2-Iodo-5-methylbenzenamine13194-69-950 % similar 2-Iodo-4-methylaniline29289-13-250 % similar 2,4-Diiodobenzenamine533-70-048 % similar O-Toluidine95-53-448 % similar 4-Iodopyridin-3-amine105752-11-246 % similar 4-Fluoro-2-iodoaniline61272-76-244 % similar

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

Same formula

4-Iodoaniline540-37-4 3-Iodoaniline626-01-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook