2-Methoxy-5-[(4-methoxyphenyl)-morpholin-4-ylmethyl]cyclohexa-2,5-diene-1,4-dione
Basic information
- CAS
66092-36-2- Standard SMILES
COC1=CC(=O)C(C(c2ccc(OC)cc2)N2CCOCC2)=CC1=O- InChIKey
NKYQAGJQXBIOPN-UHFFFAOYSA-N- Molecular formula
- C19H21NO5
- Average molar mass
- 343.4 g/mol
- Monoisotopic mass
- 343.14197277
Names & identifiers
- Preferred name
- 2-Methoxy-5-[(4-methoxyphenyl)-morpholin-4-ylmethyl]cyclohexa-2,5-diene-1,4-dione
- IUPAC
- 2-methoxy-5-[(4-methoxyphenyl)-morpholin-4-ylmethyl]cyclohexa-2,5-diene-1,4-dione
Names & synonyms
66092-36-2NSC3501222-methoxy-5-[(4-methoxyphenyl)-morpholin-4-ylmethyl]cyclohexa-2,5-diene-1,4-dioneDTXSID60319761NSC-3501222-METHOXY-5-[(4-METHOXYPHENYL)(MORPHOLIN-4-YL)METHYL]CYCLOHEXA-2,5-DIENE-1,4-DIONE
Database identifiers
- CAS
66092-36-2- PubChem CID
- 336356
- DTXSID
DTXSID60319761
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 568
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Related reactions
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Compound notes
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