chempirical

2,6-Diisopropylaniline

C12H19NCAS 24544-04-5177.29 g/mol

Open in Covalent MOL file
H2N
Primary amine

Properties

Molecular formula
C12H19N
Molar mass
177.29 g/mol
Exact mass
177.1517 Da
Melting point
−45 °C
Boiling point
257 °C
logP
3.52Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
24544-04-5
SMILES
CC(C)c1cccc(C(C)C)c1N
InChIKey
WKBALTUBRZPIPZ-UHFFFAOYSA-N
InChI
InChI=1S/C12H19N/c1-8(2)10-6-5-7-11(9(3)4)12(10)13/h5-9H,13H2,1-4H3

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Names and synonyms

8 names
  • Benzenamine, 2,6-bis(1-methylethyl)-
  • Aniline, 2,6-diisopropyl-
  • 2,6-Bis(1-methylethyl)benzenamine
  • 2,6-Diisopropylphenylamine
  • 2,6-Bis(1-methylethyl)aniline
  • N-(2,6-Diisopropylphenyl)amine
  • 2,6-Di(propan-2-yl)aniline
  • 2,6-Bis(propan-2-yl)aniline

Work with 2,6-Diisopropylaniline

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Isopropyl-6-methylaniline5266-85-372 % similar 2-Isopropylaniline643-28-756 % similar Propofol2078-54-852 % similar Bis(2,6-diisopropylphenyl)carbodiimide2162-74-546 % similar O-Cymene527-84-446 % similar 1-Bromo-2-(1-methylethyl)benzene7073-94-146 % similar 1-Iodo-2-isopropylbenzene19099-54-844 % similar 2-Isopropylphenol88-69-744 % similar

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

Same formula

4-Hexylaniline33228-45-4 N,N-Bis(1-methylethyl)benzenamine4107-98-6

Elsewhere

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