Basic information
- CAS
19990-25-1- Standard SMILES
Cc1ccc(N=C2C=CC(=O)O2)cc1- InChIKey
GBAKEEOVDSMQQB-UHFFFAOYSA-N- Molecular formula
- C11H9NO2
- Average molar mass
- 187.19 g/mol
- Monoisotopic mass
- 187.06332853
Names & identifiers
- Preferred name
- 2(5H)-Furanone,5-[(4-methylphenyl)imino]-
- IUPAC
- 5-(4-methylphenyl)iminofuran-2-one
Names & synonyms
19990-25-1NSC1442312(5H)-Furanone,5-[(4-methylphenyl)imino]-CHEMBL1078694NSC-144231DS-003393
Database identifiers
- CAS
19990-25-1- PubChem CID
- 286294
- ChEMBL
CHEMBL1078694- Nikkaji
- J2.272.500I
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 286
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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