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CAS No.: | 41295-20-9 |
---|---|
Name: | 4-AMINO-4'-METHYLDIPHENYL ETHER |
Article Data: | 25 |
Molecular Structure: | |
Formula: | C13H13NO |
Molecular Weight: | 199.252 |
Synonyms: | 4-(4-Methylphenoxy)aniline;4-(4-Tolyloxy)aniline;4-(p-Tolyloxy)phenylamine;4-Amino-4'-methyldiphenylether;4-Aminophenyl 4-methylphenyl ether;4-[(4-Methylphenyl)oxy]aniline;NSC509659;p-(p-Tolyloxy)aniline; |
EINECS: | 255-298-7 |
Density: | 1.115 g/cm3 |
Melting Point: | 122 °C |
Boiling Point: | 333.1 °C at 760 mmHg |
Flash Point: | 160.4 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 35.25000 |
LogP: | 3.95070 |
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The Benzenamine,4-(4-methylphenoxy)- is an organic compound with the formula C13H13NO. The IUPAC name of this chemical is 4-(4-methylphenoxy)aniline. With the CAS registry number 41295-20-9, it is also named as 4-(4-methylphenoxy)phenylamine. The product's categories are Amines; Phenyls & Phenyl-Het; Phenyls & Phenyl-Het. Besides, it should be stored in a closed cool and dry place.
Physical properties about Benzenamine,4-(4-methylphenoxy)- are: (1)ACD/LogP: 2.82; (2)ACD/LogD (pH 5.5): 2.73; (3)ACD/LogD (pH 7.4): 2.82; (4)ACD/BCF (pH 5.5): 66.62; (5)ACD/BCF (pH 7.4): 81.66; (6)ACD/KOC (pH 5.5): 662.94; (7)ACD/KOC (pH 7.4): 812.59; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 12.47Å2; (12)Index of Refraction: 1.608; (13)Molar Refractivity: 61.75 cm3; (14)Molar Volume: 178.5 cm3; (15)Polarizability: 24.48×10-24cm3; (16)Surface Tension: 44.7 dyne/cm; (17)Density: 1.115 g/cm3; (18)Flash Point: 160.4 °C; (19)Enthalpy of Vaporization: 57.59 kJ/mol; (20)Boiling Point: 333.1 °C at 760 mmHg; (21)Vapour Pressure: 0.00014 mmHg at 25°C.
Preparation: this chemical can be prepared by (4-nitro-phenyl)-p-tolyl ether. This reaction will need reagent aq.-ethanolic hydrochloric acid and tin.
Uses of Benzenamine,4-(4-methylphenoxy)-: it can be used to produce 2-methyl-3-(4-p-tolyloxy-phenyl)-3H-quinazolin-4-one by heating. The reaction time of 15 min. The yield is about 61%.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccc(cc1)C)c2ccc(cc2)N
(2)InChI: InChI=1/C13H13NO/c1-10-2-6-12(7-3-10)15-13-8-4-11(14)5-9-13/h2-9H,14H2,1H3
(3)InChIKey: VPCGOYHSWIYEMO-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C13H13NO/c1-10-2-6-12(7-3-10)15-13-8-4-11(14)5-9-13/h2-9H,14H2,1H3
(5)Std. InChIKey: VPCGOYHSWIYEMO-UHFFFAOYSA-N