Guanidine, N-((4-methylphenyl)methoxy)-, nitrate (1:1)
Basic information
- CAS
722-57-6- Standard SMILES
Cc1ccc(CON=C(N)N)cc1.O=[N+]([O-])O- InChIKey
LTIKXPRWJKNWKY-UHFFFAOYSA-N- Molecular formula
- C9H14N4O4
- Average molar mass
- 242.23 g/mol
- Monoisotopic mass
- 242.10150494
Names & identifiers
- Preferred name
- Guanidine, N-((4-methylphenyl)methoxy)-, nitrate (1:1)
- IUPAC
- 2-[(4-methylphenyl)methoxy]guanidine;nitric acid
Names & synonyms
GUANIDINE, ((p-METHYLBENZYL)OXY)-, NITRATE722-57-6DTXSID60222529RefChem:1086266DTXCID40145020Guanidine, N-((4-methylphenyl)methoxy)-, nitrate (1:1)((p-Methylbenzyl)oxy)guanidine nitrateNitric acid--N''-[(4-methylphenyl)methoxy]guanidine (1/1)
Database identifiers
- CAS
722-57-6- PubChem CID
- 12878
- DTXSID
DTXSID60222529
Properties
Computed structural properties
- Topological polar surface area
- 140 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 194
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Compound notes
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