Basic information
- CAS
87627-11-0- Standard SMILES
CCN(CC)CCOC(=O)Cc1cccc2c(=O)cc(-c3ccc(OC)cc3)oc12- InChIKey
LZAONEACRHDLOA-UHFFFAOYSA-N- Molecular formula
- C24H27NO5
- Average molar mass
- 409.5 g/mol
- Monoisotopic mass
- 409.18892296
Names & identifiers
- Preferred name
- 2-(Diethylamino)ethyl 2-[2-(4-methoxyphenyl)-4-oxochromen-8-yl]acetate
- IUPAC
- 2-(diethylamino)ethyl 2-[2-(4-methoxyphenyl)-4-oxochromen-8-yl]acetate
Names & synonyms
NSC35463687627-11-0DTXSID70320080NSC-3546362-(Diethylamino)ethyl [2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-8-yl]acetate
Database identifiers
- CAS
87627-11-0- PubChem CID
- 337274
- DTXSID
DTXSID70320080
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 607
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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