Basic information
- CAS
23565-16-4- Standard SMILES
NC(=Nc1cccc2ccccc12)c1ccncc1- InChIKey
RVRVOANEKLRSNU-UHFFFAOYSA-N- Molecular formula
- C16H13N3
- Average molar mass
- 247.29 g/mol
- Monoisotopic mass
- 247.11094743
Names & identifiers
- Preferred name
- Isonicotinamidine, N-1-naphthyl-
- IUPAC
- N'-naphthalen-1-ylpyridine-4-carboximidamide
- English name
- N-(1-Naphtyl)isonicotinamidine
- Molecular formula
- C16H13N3
- Molecular weight
- 247.29
Names & synonyms
N-1-NaphthylisonicotinamidineISONICOTINAMIDINE, N-1-NAPHTHYL-23565-16-4BRN 04786894-Pyridinecarboximidamide, N-1-naphthlenyl-DTXSID40178191RefChem:349662DTXCID70100682N'-(NAPHTHALEN-1-YL)PYRIDINE-4-CARBOXIMIDAMIDEN-(1-Naphtyl)isonicotinamidine4-Pyridinecarboximidamide, N-1-naphthalenyl-
Database identifiers
- CAS
23565-16-4- PubChem CID
- 32009
- DTXSID
DTXSID40178191- Nikkaji
- J68.798G
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 51.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 320
Physicochemical properties
- Boiling point
- 421.8 · 421.8±37.0 °C(Predicted)
- Density
- 1.17 · 1.17±0.1 g/cm3(Predicted)
- pka
- 5.48 · 5.48±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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