Serotonin hydrochloride

C₁₀H₁₃ClN₂OCAS 153-98-0212.68 g/mol

Open in Covalent MOL file

Phenol Primary amine

Properties

Molecular formula: C₁₀H₁₃ClN₂O
Molar mass: 212.68 g/mol
Exact mass: 212.0716 Da
Melting point: 167–168 °C
logP: 1.80Crippen estimate
Polar surface area: 62.0 Å²
H-bond donors / acceptors: 3 / 2
Rotatable bonds: 2

Hazards

Danger

H301 Toxic if swallowed14.6% of notifiers
H302 Harmful if swallowed85.4% of notifiers
H312 Harmful in contact with skin85.4% of notifiers
H315 Causes skin irritation85.4% of notifiers
H319 Causes serious eye irritation87.5% of notifiers
H332 Harmful if inhaled85.4% of notifiers
H335 May cause respiratory irritation87.5% of notifiers

Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

153-98-0

SMILES

Cl.NCCc1c[nH]c2ccc(O)cc12

InChIKey

MDIGAZPGKJFIAH-UHFFFAOYSA-N

InChI

InChI=1S/C10H12N2O.ClH/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10;/h1-2,5-6,12-13H,3-4,11H2;1H

Weigh it out

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

Names and synonyms

6 names

1H-Indol-5-ol, 3-(2-aminoethyl)-, hydrochloride (1:1)
Indol-5-ol, 3-(2-aminoethyl)-, monohydrochloride
1H-Indol-5-ol, 3-(2-aminoethyl)-, monohydrochloride
Hippophaine hydrochloride
5-Hydroxytryptamine hydrochloride
5-HT•HCl

Work with Serotonin 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.

Serotonin50-67-9Free base Serotonin adipate16031-83-7Salt

Similar compounds

5-Methyltryptamine hydrochloride1010-95-365 % similar 5-Fluorotryptamine hydrochloride2711-58-265 % similar 5-Methyltryptamine hydrochloride55795-89-665 % similar 5-Chlorotryptamine hydrochloride942-26-765 % similar Mexamine66-83-162 % similar Tryptamine hydrochloride343-94-261 % similar 5-Methyltryptamine1821-47-257 % similar 5-Chlorotryptamine3764-94-157 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Chlortoluron15545-48-9 3-Chloro-4-morpholinoaniline55048-24-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook