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| CAS No.: | 619-60-3 |
|---|---|
| Name: | 4-(Dimethylamino)phenol |
| Article Data: | 64 |
| Molecular Structure: | |
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| Formula: | C8H11NO |
| Molecular Weight: | 137.181 |
| Synonyms: | Phenol,p-(dimethylamino)- (6CI,7CI,8CI);4-(Dimethylamino)phenol;DMAP;DMAP(antidote);N,N-Dimethyl-4-aminophenol;N,N-Dimethyl-p-hydroxyaniline;p-(Dimethylamino)phenol;p-Hydroxy-N,N-dimethylaniline;4-Dimethylaminophenol; |
| EINECS: | 210-604-8 |
| Density: | 1.089 g/cm3 |
| Melting Point: | 138-141℃ |
| Boiling Point: | 259.7 °C at 760 mmHg |
| Flash Point: | 135.6 °C |
| PSA: | 23.47000 |
| LogP: | 1.45820 |
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Specification
This chemical is called Phenol,4-(dimethylamino)-, and it can also be named as 4-Dimethylaminophenol. With the molecular formula of C8H11NO, its molecular weight is 137.17904. The CAS registry number of this chemical is 619-60-3, and its EINECS number is 210-604-8. Additionally, the systematic name of this chemical is 4-(Dimethylamino)phenol.
Other characteristics of the Phenol,4-(dimethylamino)- can be summarised as follows: (1)ACD/LogP: 1.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.91; (4)ACD/LogD (pH 7.4): 1.48; (5)ACD/BCF (pH 5.5): 2.08; (6)ACD/BCF (pH 7.4): 7.81; (7)ACD/KOC (pH 5.5): 39.88; (8)ACD/KOC (pH 7.4): 149.78; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 12.47 Å2; (13)Index of Refraction: 1.589; (14)Molar Refractivity: 42.44 cm3; (15)Molar Volume: 125.8 cm3; (16)Polarizability: 16.82×10-24 cm3; (17)Surface Tension: 44 dyne/cm; (18)Density: 1.089 g/cm3; (19)Flash Point: 135.6 °C; (20)Enthalpy of Vaporization: 51.74 kJ/mol; (21)Boiling Point: 259.7 °C at 760 mmHg; (22)Vapour Pressure: 0.00789 mmHg at 25°C.
Production method of this chemical: The Phenol,4-(dimethylamino)- and 1-(5-dimethylamino-2-hydroxy-phenyl)-ethanone could be obtained by the reactant of acetic acid-(4-dimethylamino-phenyl ester). This reaction needs the reagent of triethylamine, and the solvent of 2,2,2-trifluoro-ethanol. The yield is 45 %. In addition, this reaction should be taken for 4 hours. The other condition is photolysis.
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Uses of this chemical: The p-(2,4,6-Trinitrophenoxy)-N,N-dimethylanilin could be obtained by the reactants of Phenol,4-(dimethylamino)- and 2-chloro-1,3,5-trinitro-benzene. This reaction needs the reagent of sodium carbonate, and the solvent of H2O. The yield is 35 %. This reaction should be taken for 0.5 hour at the temperature of 50-60 °C.
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You can still convert the following datas into molecular structure:
1.SMILES: Oc1ccc(N(C)C)cc1
2.InChI: InChI=1/C8H11NO/c1-9(2)7-3-5-8(10)6-4-7/h3-6,10H,1-2H3
3.InChIKey: JVVRCYWZTJLJSG-UHFFFAOYAU