Basic information
- CAS
5207-37-4- Standard SMILES
CCOc1c(Nc2ccccc2N)c2cc(Cl)ccc2oc1=O- InChIKey
DOOMFZJAXDUSIN-UHFFFAOYSA-N- Molecular formula
- C17H15ClN2O3
- Average molar mass
- 330.8 g/mol
- Monoisotopic mass
- 330.07712
Names & identifiers
- Preferred name
- 4-(2-Aminoanilino)-6-chloro-3-ethoxy-2H-1-benzopyran-2-one
- IUPAC
- 4-(2-aminoanilino)-6-chloro-3-ethoxychromen-2-one
Names & synonyms
5207-37-4NSC171762DTXSID703058374-(2-Aminoanilino)-6-chloro-3-ethoxy-2H-1-benzopyran-2-oneNSC-171762
Database identifiers
- CAS
5207-37-4- PubChem CID
- 299291
- DTXSID
DTXSID70305837
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 73.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 482
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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