1-Cyano-2-(4-methoxyphenyl)guanidine
Basic information
- CAS
41988-52-7- Standard SMILES
COc1ccc(N=C(N)NC#N)cc1- InChIKey
MWRZMMXAZFWRGY-UHFFFAOYSA-N- Molecular formula
- C9H10N4O
- Average molar mass
- 190.2 g/mol
- Monoisotopic mass
- 190.08546096
Names & identifiers
- Preferred name
- 1-Cyano-2-(4-methoxyphenyl)guanidine
- IUPAC
- 1-cyano-2-(4-methoxyphenyl)guanidine
Names & synonyms
41988-52-7NSC165771SCHEMBL11227303SCHEMBL11227305DTXSID60962135N-Cyano-N'-(4-methoxyphenyl)guanidineNSC-165771192698-29-6
Database identifiers
- CAS
41988-52-7- PubChem CID
- 296007
- DTXSID
DTXSID60962135- Nikkaji
- J599.036J
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 83.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 247
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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