Basic information
- CAS
1976-28-9- Standard SMILES
O=C([O-])c1cccnc1.O=C([O-])c1cccnc1.O=C([O-])c1cccnc1.[Al+3]- InChIKey
NSFYKDVWNTWJOK-UHFFFAOYSA-K- Molecular formula
- C18H12AlN3O6
- Average molar mass
- 393.3 g/mol
- Monoisotopic mass
- 393.0541485
Names & identifiers
- Preferred name
- Niacin aluminum
- IUPAC
- aluminum tris(pyridine-3-carboxylate)
- English name
- aluminium trinicotinate
- Molecular formula
- C18H12AlN3O6
- Molecular weight
- 393.285918
Names & synonyms
Aluminum nicotinatealuminium nicotinate1976-28-9NIACIN ALUMINUMNicotinic acid, aluminum saltTris(nicotinato)aluminumAluminum, tris(nicotinato)-Aluminum 3-pyridinecarboxylateNIACIN ALUMINIUMBDI80PUH9NEINECS 217-832-7MICALEX
Show more names
aluminium trinicotinateTris(3-pyridinecarboxylic acid)aluminum salt
3-Pyridinecarboxylic acid, aluminum saltTRIS(NICTINATO)ALUMINUMTRIS(NICTINATO)ALUMINIUMALUMINUM NICOTINATE [MI]DTXSID60173441NIACIN ALUMINIUM [WHO-DD]NICOTINIC ACID, ALUMINIUM SALTRefChem:853808
Database identifiers
- CAS
1976-28-9- PubChem CID
- 16098
- DTXSID
DTXSID60173441- ChEMBL
CHEMBL3707287- UNII
- BDI80PUH9N
- EC Number
- 217-832-7
- Nikkaji
- J199.795E
Properties
Computed structural properties
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 0
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 108
Experimental & physicochemical properties
Food AdditivesNUTRIENT SUPPLEMENT -> FDA Substance added to food
Physicochemical properties
- LogP
- 0.147 · 0.147 (est)
- CAS DataBase Reference
- 1976 · 1976-28-9
- Substances Added to Food (formerly EAFUS)
- ALUMINUM NICOTINATE
- FDA UNII
- 80 PUH9N · BDI80PUH9N
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 3-Pyridinecarboxylic acid, aluminium salt
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Chemistry & industry
Pharmacology
ATC Code
C - Cardiovascular system
QC - Cardiovascular system
Applications
UsesFood additive.
Upstream & downstream products
Upstream raw materials
Suppliers4 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
BOC Sciences[email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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