Arecoline hydrochloride
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Basic information
- CAS
61-94-9- Standard SMILES
COC(=O)C1=CCCN(C)C1.Cl- InChIKey
LQSWCSYIDIBGRR-UHFFFAOYSA-N- Molecular formula
- C8H14ClNO2
- Average molar mass
- 191.65 g/mol
- Monoisotopic mass
- 191.07130637
Names & identifiers
- Preferred name
- Arecoline hydrochloride
- IUPAC
- methyl 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate;hydrochloride
- English name
- ARECOLINE HYDROCHLORIDE
- Molecular formula
- C8H14ClNO2
- Molecular weight
- 191.66
Names & synonyms
Arecoline hydrochlorideArecoline HClCCRIS 5223EINECS 200-523-6NSC 172133UNII-9F5CR33W649F5CR33W64NSC-1721333-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-methyl-, methyl ester, hydrochlorideDTXSID8020098NICOTINIC ACID, 1,2,5,6-TETRAHYDRO-1-METHYL-, METHYL ESTER, HYDROCHLORIDE3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-methyl-, methyl ester, hydrochloride (9CI)
Show more names
RARECHEM AX KI 5022methyl 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate hydrochloridenicotinicacid,1,2,5,6-tetrahydro-1-methyl-,methylester,hydrochlorideethyl 1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylate hydrochloride3-pyridinecarboxylicacid,1,2,5,6-tetrahydro-1-methyl-,methylester,hydroc
3-PYRIDINECARBOXYLIC ACID, 1,2,5,6-TETRAHYDRO-1-METHYL-, METHYL ESTER, HYDROCHLORIDE (1:1)RefChem:113812DTXCID5098200-523-661-94-9methyl 1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylate hydrochlorideArecoline.HClArecoline (hydrochloride)
Database identifiers
- CAS
61-94-9- PubChem CID
- 6107
- DTXSID
DTXSID8020098- UNII
- 9F5CR33W64
- EC Number
- 200-523-6
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 187
Physicochemical properties
- Melting point
- 157 · 157-158 °C(Solv: ethyl ether (60-29-7))
- form
- Solid
- CAS DataBase Reference
- 61 · 61-94-9
- FDA UNII
- 9 F5CR33W64 · 9F5CR33W64
- Toxicity
- 60 mg/kg · dni-mus-ipr 60 mg/kg IJEBA6 17,1141,79
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- dni-mus-ipr 60 mg/kg IJEBA6 17,1141,79
Chemistry & industry
Applications
UsesArecoline hydrochloride, a naturally occurring psychoactive alkaloid, is a partial agonist of nicotinic and muscarinic acetylcholine receptor. Arecoline hydrochloride exhibits stimulation, alertness, anxiolysis and anti-parasitic effects. Arecoline hydrochloride also can induce oxidative stress[1][2][3][4].
Upstream & downstream products
Downstream products
Related reactions
1 records
Compound notes
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