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| CAS No.: | 24758-49-4 |
|---|---|
| Name: | 4-MORPHOLINOBENZOPHENONE |
| Article Data: | 33 |
| Molecular Structure: | |
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| Formula: | C17H17NO2 |
| Molecular Weight: | 267.327 |
| Synonyms: | Benzophenone,4-morpholino- (8CI);4-Morpholinobenzophenone;(4-Morpholin-4-yl-phenyl)-phenyl-methanone;NSC 111168;[4-(Morpholin-4-yl)phenyl](phenyl)methanone; |
| EINECS: | 246-447-7 |
| Density: | 1.157 g/cm3 |
| Melting Point: | 142-145 °C |
| Boiling Point: | 450.5 °C at 760 mmHg |
| Flash Point: | 226.3 °C |
| Hazard Symbols: | N |
| Risk Codes: | 50 |
| Safety: | 24/25 |
| PSA: | 29.54000 |
| LogP: | 2.81920 |
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Specification
The CAS registry number of Methanone,[4-(4-morpholinyl)phenyl]phenyl- is 24758-49-4. Its EINECS registry number is 246-447-7. The IUPAC name is (4-morpholin-4-ylphenyl)-phenylmethanone. In addition, the molecular formula is C17H17NO2 and the molecular weight is 267.32. It is also called 4-Morpholinobenzophenone. It is a kind of light green crystalline powder and belongs to the class of Pharmacetical. What's more, it should be stored in sealed container, and placed in a cool and dry environment.
Physical properties about this chemical are: (1)ACD/LogP: 2.56; (2)ACD/LogD (pH 5.5): 2.56; (3)ACD/LogD (pH 7.4): 2.56; (4)ACD/BCF (pH 5.5): 51.54; (5)ACD/BCF (pH 7.4): 51.57; (6)ACD/KOC (pH 5.5): 584.93; (7)ACD/KOC (pH 7.4): 585.22; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 29.54 Å2; (11)Index of Refraction: 1.589; (12)Molar Refractivity: 77.85 cm3; (13)Molar Volume: 230.8 cm3; (14)Polarizability: 30.86 ×10-24cm3; (15)Surface Tension: 45.1 dyne/cm; (16)Density: 1.157 g/cm3; (17)Flash Point: 226.3 °C; (18)Enthalpy of Vaporization: 70.94 kJ/mol; (19)Boiling Point: 450.5 °C at 760 mmHg; (20)Vapour Pressure: 2.62E-08 mmHg at 25°C.
Preparation of Methanone,[4-(4-morpholinyl)phenyl]phenyl-: it can be prepared by 2-[4-(4-Morpholinyl)phenyl]-2-phenyl-1,3-dithian. This reaction will need reagent HgCl2/HgO and solvents H2O and methanol. The reaction time is 12 hours by heating. The yield is about 80%.
![Methanone,[4-(4-morpholinyl)phenyl]phenyl- can be prepared by 2-[4-(4-Morpholinyl)phenyl]-2-phenyl-1,3-dithian.](/UserFilesUpload/Preparation of Methanone,[4-(4-morpholinyl)phenyl]phenyl-.jpg)
Uses of Methanone,[4-(4-morpholinyl)phenyl]phenyl-: it can react with 1-(4-bromo-phenyl)-pyrrolidine to get (4-morpholin-4-yl-phenyl)-phenyl-(4-pyrrolidin-1-yl-phenyl)-methanol. This reaction will need reagent n-BuLi-TMEDA complex and solvent diethyl ether. The reaction time is 45 minutes at reaction temperature of 20 °C by. The yield is about 66%.
![Methanone,[4-(4-morpholinyl)phenyl]phenyl- can react with 1-(4-bromo-phenyl)-pyrrolidine to get (4-morpholin-4-yl-phenyl)-phenyl-(4-pyrrolidin-1-yl-phenyl)-methanol.](/UserFilesUpload/Uses of Methanone,[4-(4-morpholinyl)phenyl]phenyl-.png)
When you are using this chemical, please be cautious about it as the following:
During using it, you should avoid contact with skin and eyes.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1)c3ccc(N2CCOCC2)cc3
(2)InChI: InChI=1/C17H17NO2/c19-17(14-4-2-1-3-5-14)15-6-8-16(9-7-15)18-10-12-20-13-11-18/h1-9H,10-13H2
(3)InChIKey: CGCQHMFVCNWSOV-UHFFFAOYAW