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CAS No.: | 56705-83-0 |
---|---|
Name: | 4-(o-tolyloxy)aniline |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C13H13NO |
Molecular Weight: | 199.252 |
Synonyms: | 4-(o-Tolyloxy)aniline;4-(o-Tolyloxy)phenylamine;p-(o-Tolyloxy)aniline; |
EINECS: | 260-349-1 |
Density: | 1.115g/cm3 |
Melting Point: | 61-62℃ |
Boiling Point: | 326.8 °C at 760 mmHg |
Flash Point: | 155.3 °C |
PSA: | 35.25000 |
LogP: | 3.95070 |
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The Benzenamine,4-(2-methylphenoxy)-, with CAS registry number 56705-83-0, has the systematic name of 4-(2-methylphenoxy)aniline. Besides this, it is also called 4-Aminophenyl 2-methylphenyl ether. And the chemical formula of this chemical is C13H13NO. What's more, its EINECS is 260-349-1.
Physical properties of Benzenamine,4-(2-methylphenoxy)-: (1)ACD/LogP: 2.82; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.75; (4)ACD/LogD (pH 7.4): 2.82; (5)ACD/BCF (pH 5.5): 69.02; (6)ACD/BCF (pH 7.4): 81.7; (7)ACD/KOC (pH 5.5): 686.77; (8)ACD/KOC (pH 7.4): 813.02; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 12.47 Å2; (13)Index of Refraction: 1.608; (14)Molar Refractivity: 61.75 cm3; (15)Molar Volume: 178.5 cm3; (16)Polarizability: 24.48×10-24cm3; (17)Surface Tension: 44.7 dyne/cm; (18)Density: 1.115 g/cm3; (19)Flash Point: 155.3 °C; (20)Enthalpy of Vaporization: 56.9 kJ/mol; (21)Boiling Point: 326.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000211 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccc(N)cc1)c2ccccc2C
(2)InChI: InChI=1/C13H13NO/c1-10-4-2-3-5-13(10)15-12-8-6-11(14)7-9-12/h2-9H,14H2,1H3
(3)InChIKey: JPCCVWJJMUIBJR-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C13H13NO/c1-10-4-2-3-5-13(10)15-12-8-6-11(14)7-9-12/h2-9H,14H2,1H3
(5)Std. InChIKey: JPCCVWJJMUIBJR-UHFFFAOYSA-N