2-Isopropylaniline
Properties
- Molecular formula
- C9H13N
- Molar mass
- 135.21 g/mol
- Exact mass
- 135.1048 Da
- Density
- 0.976 g/mL (at 12 °C)
- Melting point
- 277–279 °C
- Boiling point
- 221 °C
- logP
- 2.39Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Identifiers
CAS number
643-28-7SMILES
CC(C)c1ccccc1NInChIKey
YKOLZVXSPGIIBJ-UHFFFAOYSA-NInChI
InChI=1S/C9H13N/c1-7(2)8-5-3-4-6-9(8)10/h3-7H,10H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
15 names · show all
- Benzenamine, 2-(1-methylethyl)-
- Aniline, o-isopropyl-
- 2-(1-Methylethyl)benzenamine
- o-Isopropylaniline
- o-Cumidine
- 2-Aminoisopropylbenzene
- o-Aminoisopropylbenzene
- 1-Amino-2-isopropylbenzene
- o-Aminocumene
- 2-(1-Methylethyl)aniline
- (2-Isopropylphenyl)amine
- 2-Isopropylbenzenamine
- [2-(1-Methylethyl)phenyl]amine
- 2-Propan-2-ylaniline
- 2-(Propan-2-yl)aniline
Work with 2-Isopropylaniline
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
2,6-Diisopropylaniline24544-04-556 % similar
O-Cymene527-84-450 % similar
1-Bromo-2-(1-methylethyl)benzene7073-94-150 % similar
1-Iodo-2-isopropylbenzene19099-54-848 % similar
2-Isopropylphenol88-69-748 % similar
2-Aminobenzhydrol13209-38-647 % similar
2-Isopropyl-6-methylaniline5266-85-347 % similar
Propofol2078-54-844 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds