chempirical

(γ-Chloro-β-methylpropyl)dimethylamine-hydrochloride

C6H15Cl2NCAS 4261-67-0172.09 g/mol

Open in Covalent MOL file
ClNHCl
Alkyl halideTertiary amine

Properties

Molecular formula
C6H15Cl2N
Molar mass
172.09 g/mol
Exact mass
171.0582 Da
Melting point
172 °C
logP
1.84Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Identifiers

CAS number
4261-67-0
SMILES
CC(CCl)CN(C)C.Cl
InChIKey
SOMIBONUMGNAEP-UHFFFAOYSA-N
InChI
InChI=1S/C6H14ClN.ClH/c1-6(4-7)5-8(2)3;/h6H,4-5H2,1-3H3;1H

Weigh it out

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

Names and synonyms

8 names
  • 1-Propanamine, 3-chloro-N,N,2-trimethyl-, hydrochloride (1:1)
  • 1-Propanamine, 3-chloro-N,N,2-trimethyl-, hydrochloride
  • Propylamine, 3-chloro-N,N,2-trimethyl-, hydrochloride
  • 2-Methyl-3-(dimethylamino)propyl chloride hydrochloride
  • 3-(Dimethylamino)-2-methylpropyl chloride hydrochloride
  • 2,N,N-Trimethylaminopropyl chloride hydrochloride
  • 1-Chloro-2-methyl-3-(N,N-dimethylamino)propane hydrochloride
  • 1-Chloro-3-(dimethylamino)-2-methylpropane hydrochloride

Work with (γ-Chloro-β-methylpropyl)dimethylamine-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

2-Chloro-N,N-dimethyl-1-propanamine hydrochloride4584-49-050 % similar 1-Bromo-3-chloro-2-methylpropane6974-77-244 % similar 1-Chloro-2-methylbutane616-13-741 % similar Dimethylaminoethyl chloride hydrochloride4584-46-739 % similar 3-Dimethylaminopropyl chloride hydrochloride1281-00-137 % similar 3-(Dimethylamino)propyl chloride hydrochloride5407-04-537 % similar Dimethylaminoisopropanol108-16-734 % similar (±)-Trimeprazine84-96-833 % similar

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

Same formula

2-(Diethylamino)ethyl chloride hydrochloride869-24-9

Elsewhere

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