Basic information
- CAS
3471-05-4- Standard SMILES
c1cncc(C2=NCCCC2)c1- InChIKey
AUBPMADJYNSPOA-UHFFFAOYSA-N- Molecular formula
- C10H12N2
- Average molar mass
- 160.22 g/mol
- Monoisotopic mass
- 160.10004839
Overview
Anabaseine is a member of bipyridines.
Names & identifiers
- Preferred name
- Anabaseine
- IUPAC
- 3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine
- English name
- anabaseine
- Molecular formula
- C10H12N2
- Molecular weight
- 160.219
Names & synonyms
Anabaseine3471-05-43,4,5,6-Tetrahydro-2,3'-bipyridine3-(2,3,4,5-tetrahydropyridin-6-yl)pyridine2,3'-BIPYRIDINE, 3,4,5,6-TETRAHYDRO-DYE103K23IDTXSID50188266RefChem:112471DTXCID801107573-(3,4,5,6-tetrahydropyridin-2-yl)pyridineBRN 0125981UNII-DYE103K23I
Show more names
Anabaseine hydrochloride
SCHEMBL261062orb1984497CHEMBL1230982SCHEMBL30394330CHEBI:80787US8609708, 74 AnabaseineBDBM109773AKOS000277414
Database identifiers
- CAS
3471-05-4- PubChem CID
- 18985
- DTXSID
DTXSID50188266- ChEMBL
CHEMBL1230982- ChEBI
CHEBI:80787- UNII
- DYE103K23I
- Nikkaji
- J575.372D
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 175
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Boiling point
- 110 · 110-120℃
- Density
- 1.0849 · 1.0849 (rough estimate)
- refractive index
- 1.56 · 1.5600 (estimate)
- storage temp.
- Refrigerator, Under Inert Atmosphere
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
- form
- Thick Oil
- pka
- 6.31 · 6.31±0.20(Predicted)
- color
- Pale Brown to Very Dark Brown
- FDA UNII
- 103 K23I · DYE103K23I
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationPesticides designed to control insects that are harmful to man. The insects may be directly harmful, as those acting as disease vectors, or indirectly harmful, as destroyers of crops, food products, or textile fabrics.
Applications
UsesA naturally occurring neurotoxin produced by hoplonemertine sea worms competes with the natural neurotransmitter acetylcholine when binding to nicotinic receptor sites.
Suppliers6 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海复青化学科技有限公司13816107857 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Additional notes
DefinitionChEBI: Anabaseine is a member of bipyridines.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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