N,N-Bis(1-methylethyl)benzenamine

C₁₂H₁₉NCAS 4107-98-6177.29 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₉N
Molar mass: 177.29 g/mol
Exact mass: 177.1517 Da
Melting point: 50–52 °C
Boiling point: 205–210 °C (at 0.1 Torr)
logP: 3.31Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Identifiers

CAS number

4107-98-6

SMILES

CC(C)N(c1ccccc1)C(C)C

InChIKey

OVSARSKQWCLSJT-UHFFFAOYSA-N

InChI

InChI=1S/C12H19N/c1-10(2)13(11(3)4)12-8-6-5-7-9-12/h5-11H,1-4H3

Weigh it out

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

Names and synonyms

4 names

Benzenamine, N,N-bis(1-methylethyl)-
Aniline, N,N-diisopropyl-
N,N-Diisopropylaniline
N,N-Diisopropylbenzenamine

Work with N,N-Bis(1-methylethyl)benzenamine

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

Propachlor1918-16-744 % similar Dimethylaniline121-69-743 % similar N-Methyl-N-phenylbenzenamine552-82-943 % similar N,N-Bis(1-methylethyl)benzamide20383-28-240 % similar 1-Phenylethyl chloride672-65-138 % similar Diethylaniline91-66-738 % similar N,N-Diphenylhydrazine530-50-738 % similar 1,1-Diphenylethane612-00-038 % similar

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

Same formula

2,6-Diisopropylaniline24544-04-5 4-Hexylaniline33228-45-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook