4H-1-Benzopyran-4-one, 2,3-dihydro-2-(4-methylphenyl)-, O-(2-(diethylamino)ethyl)oxime
Basic information
- CAS
75393-02-1- Standard SMILES
CCN(CC)CCO/N=C1/CC(c2ccc(C)cc2)Oc2ccccc21- InChIKey
ULFHNFLEWFXXRD-ATJXCDBQSA-N- Molecular formula
- C22H28N2O2
- Average molar mass
- 352.5 g/mol
- Monoisotopic mass
- 352.21507814
Names & identifiers
- Preferred name
- 4H-1-Benzopyran-4-one, 2,3-dihydro-2-(4-methylphenyl)-, O-(2-(diethylamino)ethyl)oxime
- IUPAC
- N,N-diethyl-2-[(Z)-[2-(4-methylphenyl)-2,3-dihydrochromen-4-ylidene]amino]oxyethanamine
Names & synonyms
4H-1-Benzopyran-4-one, 2,3-dihydro-2-(4-methylphenyl)-, O-(2-(diethylamino)ethyl)oxime75393-02-1RefChem:10718192,3-Dihydro-2-(4-methylphenyl)-4H-1-benzopyran-4-one O-(2-(diethylamino)ethyl)oxime
Database identifiers
- CAS
75393-02-1- PubChem CID
- 6509995
- Nikkaji
- J860.854G
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 441
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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