Diisopropylammonium chloride

C6H16ClNCAS 819-79-4137.65 g/mol

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NHHCl
Secondary amine

Properties

Molecular formula
C6H16ClN
Molar mass
137.65 g/mol
Exact mass
137.0971 Da
Melting point
210.5–213 °C
logP
1.81Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
819-79-4
SMILES
CC(C)NC(C)C.Cl
InChIKey
URAZVWXGWMBUGJ-UHFFFAOYSA-N
InChI
InChI=1S/C6H15N.ClH/c1-5(2)7-6(3)4;/h5-7H,1-4H3;1H

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Names and synonyms

5 names
  • 2-Propanamine, N-(1-methylethyl)-, hydrochloride (1:1)
  • Diisopropylamine, hydrochloride
  • 2-Propanamine, N-(1-methylethyl)-, hydrochloride
  • Diethylamine, dimethyl-, hydrochloride
  • Bis(isopropyl)ammonium chloride

Work with Diisopropylammonium chloride

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Diisopropylamine108-18-9Free base Lithium diisopropylamide4111-54-0Salt Diisopropylammonium dichloroacetate660-27-5Salt

Similar compounds

Isopropylhydrazine hydrochloride16726-41-350 % similar N-Isopropylhydroxylamine hydrochloride50632-53-650 % similar Isopropylcyclohexylamine1195-42-238 % similar 4-Bromo-N-isopropylamphetamine hydrochloride109971-39-335 % similar Methylisopropylamine4747-21-135 % similar Monoisopropylammonium chloride15572-56-233 % similar 7-Azabicyclo[2,2,1]heptane hydrochloride27514-07-433 % similar N,N′-Diisopropylethylenediamine4013-94-933 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Hexylammonium chloride142-81-4 Triethylamine monohydrochloride554-68-7 1,3-Dimethylbutylamine hydrochloride71776-70-0

Elsewhere

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