Basic information
- CAS
45458-31-9- Standard SMILES
N[n+]1ccccc1- InChIKey
PFZCOWLKXHIVII-UHFFFAOYSA-N- Molecular formula
- C5H7N2+
- Average molar mass
- 95.12 g/mol
- Monoisotopic mass
- 95.06037464
Names & identifiers
- Preferred name
- Pyridinium, 1-amino-
- IUPAC
- pyridin-1-ium-1-amine
Names & synonyms
Pyridinium, 1-amino-45458-31-9DTXSID20328733RefChem:377042DTXCID402798391-AMINOPYRIDIN-1-IUMpyridin-1-ium-1-amineaminopyridiniumSCHEMBL27036SCHEMBL11972306PFZCOWLKXHIVII-UHFFFAOYSA-N
Database identifiers
- CAS
45458-31-9- PubChem CID
- 413556
- DTXSID
DTXSID20328733- Nikkaji
- J253.060K
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 29.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 1
- Complexity
- 48
Related reactions
10 records
Compound notes
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