Aminoacetonitrile hydrochloride

C2H5ClN2CAS 6011-14-992.53 g/mol

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HClNNH2
NitrilePrimary amine

Properties

Molecular formula
C2H5ClN2
Molar mass
92.53 g/mol
Exact mass
92.0141 Da
Melting point
160–166 °C (decomposes)
logP
-0.11Crippen estimate
Polar surface area
49.8 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

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
6011-14-9
SMILES
Cl.N#CCN
InChIKey
XFKYKTBPRBZDFG-UHFFFAOYSA-N
InChI
InChI=1S/C2H4N2.ClH/c3-1-2-4;/h1,3H2;1H

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Names and synonyms

8 names
  • Acetonitrile, 2-amino-, hydrochloride (1:1)
  • Glycinonitrile, monohydrochloride
  • Acetonitrile, amino-, monohydrochloride
  • Aminoacetonitrile monohydrochloride
  • Glycinonitrile hydrochloride
  • 2-Aminoacetonitrile hydrochloride
  • α-Aminoacetonitrile hydrochloride
  • Cyanomethanamine hydrochloride

Work with Aminoacetonitrile 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

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.

Aminoacetonitrile540-61-4Free base Aminoacetonitrile bisulfate151-63-3Salt Glycinonitrile sulfate (2:1)5466-22-8Salt

Similar compounds

Prop-2-ynylamine hydrochloride15430-52-143 % similar Aminopropionitrile151-18-838 % similar N-Methylaminoacetonitrile hydrochloride25808-30-438 % similar Malononitrile109-77-333 % similar Succinonitrile110-61-233 % similar Ethylenediamine hydrochloride18299-54-233 % similar Ethylenediamine hydrochloride333-18-633 % similar 1-Aminocyclopropanecarbonitrile hydrochloride127946-77-432 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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