Basic information
- CAS
68339-78-6- Standard SMILES
N=C(N)[NH2+]Cc1ccc2ccccc2n1.O=[N+]([O-])[O-]- InChIKey
JUNQMQOLHDQMNU-UHFFFAOYSA-O- Molecular formula
- C11H13N5O3
- Average molar mass
- 263.25 g/mol
- Monoisotopic mass
- 263.10183929
Names & identifiers
- Preferred name
- Guanidine, (2-quinolinylmethyl)-, mononitrate
- IUPAC
- carbamimidoyl(quinolin-2-ylmethyl)azanium nitrate
Names & synonyms
2-Guanidinomethylquinoline nitrate(2-Quinolinylmethyl)guanidine mononitrateGUANIDINE, (2-QUINOLINYLMETHYL)-, MONONITRATE68339-78-6RefChem:346748
Database identifiers
- CAS
68339-78-6- PubChem CID
- 50148
Properties
Computed structural properties
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 247
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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