Basic information
- CAS
31858-72-7- Standard SMILES
COc1cc(C(=O)c2ccc(Cl)cc2)cc(OC)c1OCCOCCN1CCOCC1- InChIKey
YNDNXGTXNIOZDQ-UHFFFAOYSA-N- Molecular formula
- C23H28ClNO6
- Average molar mass
- 449.9 g/mol
- Monoisotopic mass
- 449.1605153
Names & identifiers
- Preferred name
- Benzophenone, 4'-chloro-3,5-dimethoxy-4-(2-(2-morpholinoethoxy)ethoxy)-
- IUPAC
- (4-chlorophenyl)-[3,5-dimethoxy-4-[2-(2-morpholin-4-ylethoxy)ethoxy]phenyl]methanone
- English name
- 4'-Chloro-3,5-dimethoxy-4-[2-(2-morpholinoethoxy)ethoxy]benzophenone
- Molecular formula
- C23H28ClNO6
- Molecular weight
- 449.92
Names & synonyms
31858-72-7BENZOPHENONE, 4'-CHLORO-3,5-DIMETHOXY-4-(2-(2-MORPHOLINOETHOXY)ETHOXY)-4'-Chloro-3,5-dimethoxy-4-(2-(2-morpholinoethoxy)ethoxy)benzophenoneDTXSID80185723RefChem:328142DTXCID20108214(4-chlorophenyl)(3,5-dimethoxy-4-{2-[2-(morpholin-4-yl)ethoxy]ethoxy}phenyl)methanone4'-Chloro-3,5-dimethoxy-4-[2-(2-morpholinoethoxy)ethoxy]benzophenoneBenzophenone, 4'-chloro-3,5-dimethoxy-4-[2-(2-morpholinoethoxy)ethoxy]- (8CI)
Database identifiers
- CAS
31858-72-7- PubChem CID
- 35958
- DTXSID
DTXSID80185723- Nikkaji
- J132.045I
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 510
Physicochemical properties
- Boiling point
- 591.5 · 591.5±50.0 °C(Predicted)
- Density
- 1.209 · 1.209±0.06 g/cm3(Predicted)
- pka
- 6.55 · 6.55±0.10(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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