3-Chloro-N,N-dimethyl-1-propanamine

C5H12ClNCAS 109-54-6121.61 g/mol

Open in Covalent MOL file
NCl
Alkyl halideTertiary amine

Properties

Molecular formula
C5H12ClN
Molar mass
121.61 g/mol
Exact mass
121.0658 Da
Density
0.9287 g/mL (at 20 °C)
Melting point
182–188 °C
Boiling point
140 °C
logP
1.18Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 50 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P330, P337+P317, P363, P403+P233, P405, P501

Identifiers

CAS number
109-54-6
SMILES
CN(C)CCCCl
InChIKey
NYYRRBOMNHUCLB-UHFFFAOYSA-N
InChI
InChI=1S/C5H12ClN/c1-7(2)5-3-4-6/h3-5H2,1-2H3

Weigh it out

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

Names and synonyms

25 names · show all
  • 1-Propanamine, 3-chloro-N,N-dimethyl-
  • Propylamine, 3-chloro-N,N-dimethyl-
  • 3-(Dimethylamino)propyl chloride
  • 3-(N,N-Dimethylamino)propyl chloride
  • (3-Chloropropyl)dimethylamine
  • γ-Chloropropyldimethylamine
  • γ-Dimethylaminopropyl chloride
  • 3-Chloro-N,N-dimethylpropanamine
  • 3-Chloro-N,N-dimethylpropylamine
  • 3-(Dimethylamino)chloropropane
  • Dimethylaminopropyl chloride
  • N-(3-Chloropropyl)dimethylamine
  • N,N-Dimethyl-3-chloropropylamine
  • 3-Dimethylamino-1-chloropropane
  • N-(3-Chloropropyl)-N,N-dimethylamine
  • N,N-Dimethyl-3-chloro-1-propanamine
  • Dimethyl(3-chloropropyl)amine
  • 1-Dimethylamino-3-chloropropane
  • 3-(Dimethylamino)-1-propyl chloride
  • 1-Chloro-3-(dimethylamino)propane
  • 3-Chloro-1-(dimethylamino)propane
  • 3-Dimethylaminopropan-1-yl chloride
  • N,N-Dimethyl-3-chloropropanamine
  • 3-Chloro-1-(N,N-dimethylamino)propane
  • 3-(N,N-Dimethylamino)-1-chloropropane

Work with 3-Chloro-N,N-dimethyl-1-propanamine

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

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.

3-(Dimethylamino)propyl chloride hydrochloride5407-04-5Salt 3-Dimethylaminopropyl chloride hydrochloride1281-00-1Salt

Similar compounds

2-(Dimethylamino)ethyl chloride107-99-367 % similar N,N,N',N'-Tetramethyl-1,3-diaminopropane110-95-259 % similar N1,N1,N4,N4-Tetramethyl-1,4-butanediamine111-51-359 % similar Dimethylaminoethyl chloride hydrochloride4584-46-757 % similar Tetramethylhexamethylenediamine111-18-256 % similar 1-(3-Chloropropyl)-4-methylpiperazine104-16-550 % similar 3-Chloro-N,N-diethyl-1-propanamine104-77-848 % similar N1-[3-(Dimethylamino)propyl]-N1,N3,N3-trimethyl-1,3-propanediamine3855-32-148 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(2R)-(-)-2-Methylpyrrolidine hydrochloride135324-85-5 (S)-2-Methylpyrrolidine hydrochloride174500-74-4 1-Methylcyclobutan-1-amine hydrochloride174886-05-6 Cyclobutylmethylamine hydrochloride5454-82-0 2-Methylpyrrolidine hydrochloride54677-53-1 Piperidinium chloride6091-44-7

Elsewhere

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