chempirical

Propargylamine hydrochloride

C3H6ClNCAS 15430-52-191.54 g/mol

Open in Covalent MOL file
NH2HCl
AlkynePrimary amine

Properties

Molecular formula
C3H6ClN
Molar mass
91.54 g/mol
Exact mass
91.0189 Da
Melting point
178–179 °C
logP
0.00Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
15430-52-1
SMILES
C#CCN.Cl
InChIKey
IKXNIQJDNKPPCH-UHFFFAOYSA-N
InChI
InChI=1S/C3H5N.ClH/c1-2-3-4;/h1H,3-4H2;1H

Weigh it out

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

Names and synonyms

4 names
  • 2-Propyn-1-amine, hydrochloride
  • 2-Propynylamine, hydrochloride
  • Propargylammonium chloride
  • Propynylammonium chloride

Work with Propargylamine hydrochloride

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

Propargylamine2450-71-780 % similar Aminoacetonitrile hydrochloride6011-14-943 % similar Ethylenediamine hydrochloride18299-54-233 % similar Ethylenediamine hydrochloride333-18-633 % similar 1,5-Hexadiyne628-16-033 % similar 1,3-Diaminopropane dihydrochloride10517-44-930 % similar 1,6-Heptadiyne2396-63-630 % similar 1,7-Octadiyne871-84-130 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook