Basic information
- CAS
15991-05-6- Standard SMILES
NC(N)=Nc1ccc2oc(=O)ccc2c1- InChIKey
OFZKVNIFUSQLMB-UHFFFAOYSA-N- Molecular formula
- C10H9N3O2
- Average molar mass
- 203.2 g/mol
- Monoisotopic mass
- 203.06947654
Names & identifiers
- Preferred name
- N-(2-Oxo-2H-chromen-6-yl)guanidine
- IUPAC
- 2-(2-oxochromen-6-yl)guanidine
Names & synonyms
N-(2-Oxo-2H-chromen-6-yl)guanidine15991-05-6NSC 72152NSC72152NSC-72152VK2QZ5JP2LNCIOpen2_003544SCHEMBL9317607SCHEMBL9317611CHEMBL18299631-(2-oxochromen-6-yl)guanidineDTXSID70166768
Show more names
N''-(2-Oxo-2H-1-benzopyran-6-yl)guanidine
Database identifiers
- CAS
15991-05-6- PubChem CID
- 415705
- DTXSID
DTXSID70166768- ChEMBL
CHEMBL1829963- UNII
- VK2QZ5JP2L
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 321
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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