chempirical

Methylisopropylamine

C4H11NCAS 4747-21-173.14 g/mol

Open in Covalent MOL file
NH
Secondary amine

Properties

Molecular formula
C4H11N
Molar mass
73.14 g/mol
Exact mass
73.0891 Da
Density
0.7026 g/mL (at 19 °C)
Boiling point
50.4 °C
logP
0.61Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Danger
Flammable (GHS02)Corrosive (GHS05)Acute Toxic (GHS06)

Aggregated from 148 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number
4747-21-1
SMILES
CNC(C)C
InChIKey
XHFGWHUWQXTGAT-UHFFFAOYSA-N
InChI
InChI=1S/C4H11N/c1-4(2)5-3/h4-5H,1-3H3

Weigh it out

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

Names and synonyms

17 names · show all
  • 2-Propanamine, N-methyl-
  • Ethylamine, N,1-dimethyl-
  • Isopropylamine, N-methyl-
  • N-Methylisopropylamine
  • 2-(Methylamino)propane
  • Isopropylmethylamine
  • N,1-Dimethylethylamine
  • N-Methyl-N-isopropylamine
  • N-Methyl-2-propanamine
  • N-Isopropyl-N-methylamine
  • N-Methyl-N-(1-methylethyl)amine
  • N-Isopropylmethylamine
  • NSC 1065
  • Methyl(1-methylethyl)amine
  • (Methyl)(propan-2-yl)amine
  • Methyl(propan-2-yl)amine
  • N-Methyl-2-propylamine

Work with Methylisopropylamine

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

Diisopropylamine108-18-943 % similar N,N′-Diisopropylethylenediamine4013-94-935 % similar Diisopropylammonium chloride819-79-435 % similar N-Ethyl-2-propanamine19961-27-432 % similar 1-N,2-N-Dimethylcyclohexane-1,2-diamine61798-24-132 % similar trans-N,N′-Dimethyl-1,2-cyclohexanediamine67579-81-132 % similar (1R,2R)-N,N'-Dimethyl-1,2-cyclohexanediamine68737-65-532 % similar (1S,2S)-N,N'-Dimethyl-1,2-cyclohexanediamine87583-89-932 % similar

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

Same formula

n-Butylamine109-73-9 Diethylamine109-89-7 (-)-sec-Butylamine13250-12-9 sec-Butylamine13952-84-6 (±)-sec-Butylamine33966-50-6 (S)-sec-Butylamine513-49-5 N,N-Dimethylethylamine598-56-1 N-Methylpropylamine627-35-0

Elsewhere

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