Pyridinium, 1-butyl-, nitrate
Basic information
- CAS
203389-24-6- Standard SMILES
CCCC[n+]1ccccc1.O=[N+]([O-])[O-]- InChIKey
LESUBZNRBDUXOH-UHFFFAOYSA-N- Molecular formula
- C9H14N2O3
- Average molar mass
- 198.22 g/mol
- Monoisotopic mass
- 198.10044231
Names & identifiers
- Preferred name
- Pyridinium, 1-butyl-, nitrate
- IUPAC
- 1-butylpyridin-1-ium nitrate
- English name
- Pyridinium, 1-butyl-, nitrate (1:1)
- Molecular formula
- C9H14N2O3
- Molecular weight
- 198.22
Names & synonyms
Pyridinium, 1-butyl-, nitrate203389-24-6DTXSID00436885RefChem:377051DTXCID20387709n-butylpyridinium nitrate1-butylpyridinium nitrateSCHEMBL15718971-BUTYLPYRIDIN-1-IUM NITRATEPyridinium, 1-butyl-, nitrate (1:1)
Database identifiers
- CAS
203389-24-6- PubChem CID
- 10219824
- DTXSID
DTXSID00436885
Properties
Computed structural properties
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 93.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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