Arecaidine
Properties
- Molecular formula
- C7H11NO2
- Molar mass
- 141.17 g/mol
- Exact mass
- 141.0790 Da
- Melting point
- 232 °C (decomposes)
- Boiling point
- 104–112 °C (at NaN Torr)
- pKa
- 9.07
- logP
- 0.33Crippen estimate
- Polar surface area
- 40.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed20% of notifiers
- H315 Causes skin irritation80% of notifiers
- H319 Causes serious eye irritation80% of notifiers
- H335 May cause respiratory irritation80% of notifiers
Aggregated from 5 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
499-04-7SMILES
CN1CCC=C(C(=O)O)C1InChIKey
DNJFTXKSFAMXQF-UHFFFAOYSA-NInChI
InChI=1S/C7H11NO2/c1-8-4-2-3-6(5-8)7(9)10/h3H,2,4-5H2,1H3,(H,9,10)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- 3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-methyl-
- Nicotinic acid, 1,2,5,6-tetrahydro-1-methyl-
- 1,2,5,6-Tetrahydro-1-methyl-3-pyridinecarboxylic acid
- N-Methylguvacine
- NSC 76017
- Arecaine
- 1-Methyl-1,2,5,6-tetrahydropyridine-3-carboxylic acid
- 1-Methyl-1,2,5,6-tetrahydropyridine-3-carboxylicacid
- 1-Methyl-1,2,5,6-tetrahydro-pyridine-3-carboxylic acid
Work with Arecaidine
Similar compounds
Arecoline63-75-256 % similar
Arecoline hydrobromide300-08-351 % similar
1-Cyclopentene-1-carboxylic acid1560-11-845 % similar
1-Cyclohexene-1-carboxylic acid636-82-844 % similar
Methyliminodiacetic acid4408-64-436 % similar
1-Methylpyrrolidin-3-one68165-06-035 % similar
(4-Methyl-piperazin-1-yl)-acetic acid54699-92-235 % similar
(E)-2-Methyl-2-pentenoic acid16957-70-332 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.