5-Chlorotryptamine hydrochloride

C10H12Cl2N2CAS 942-26-7231.12 g/mol

Open in Covalent MOL file
HClH2NNHCl
Aryl halidePrimary amine

Properties

Molecular formula
C10H12Cl2N2
Molar mass
231.12 g/mol
Exact mass
230.0378 Da
Melting point
300 °C (decomposes)
logP
2.74Crippen estimate
Polar surface area
41.8 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 9 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
942-26-7
SMILES
Cl.NCCc1c[nH]c2ccc(Cl)cc12
InChIKey
PBANXRNIXGEHPZ-UHFFFAOYSA-N
InChI
InChI=1S/C10H11ClN2.ClH/c11-8-1-2-10-9(5-8)7(3-4-12)6-13-10;/h1-2,5-6,13H,3-4,12H2;1H

Weigh it out

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

Names and synonyms

8 names
  • 1H-Indole-3-ethanamine, 5-chloro-, hydrochloride (1:1)
  • Indole, 3-(2-aminoethyl)-5-chloro-, hydrochloride
  • 1H-Indole-3-ethanamine, 5-chloro-, monohydrochloride
  • 2-(5-Chloro-1H-indol-3-yl)ethan-1-amine hydrochloride
  • 2-(5-Chloro-1H-indol-3-yl)-ethylamine; hydrochloride
  • 2-(5-Chloro-1H-indol-3-yl)ethanamine hydrochloride
  • 2-(5-Chloro-1H-indol-3-yl)ethan-1-aminium chloride
  • 5-Chloro-1H-indole-3-ethylamine monohydrochloride

Work with 5-Chlorotryptamine 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.

5-Chlorotryptamine3764-94-1Free base

Similar compounds

5-Methyltryptamine hydrochloride1010-95-365 % similar Serotonin hydrochloride153-98-065 % similar 5-Fluorotryptamine hydrochloride2711-58-265 % similar 5-Methyltryptamine hydrochloride55795-89-665 % similar Mexamine66-83-162 % similar Tryptamine hydrochloride343-94-261 % similar 5-Methyltryptamine1821-47-257 % similar Serotonin50-67-957 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,3-Dichlorophenylpiperazine41202-77-1 1-(3,5-Dichlorophenyl)piperazine55827-50-4 1-(3,4-Dichlorophenyl)piperazine57260-67-0

Elsewhere

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