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41295-20-9

Basic Information
CAS No.: 41295-20-9
Name: 4-AMINO-4'-METHYLDIPHENYL ETHER
Article Data: 25
Molecular Structure:
Molecular Structure of 41295-20-9 (4-AMINO-4'-METHYLDIPHENYL ETHER)
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: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 35.25000
LogP: 3.95070
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Specification

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