Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

4-Phenoxyaniline

Related Products

Hot Products

Name

4-Phenoxyaniline

EINECS 205-367-2
CAS No. 139-59-3 Density 1.141 g/cm3
PSA 35.25000 LogP 3.64230
Solubility < 1 g/L (20 °C) in water Melting Point 82-84 °C(lit.)
Formula C12H11NO Boiling Point 320 °C at 760 mmHg
Molecular Weight 185.225 Flash Point 155.8 °C
Transport Information N/A Appearance brown to green-brown crystalline flakes or powder
Safety 26-36/37/39-61-45-24 Risk Codes 22-36/37/38-43-68-50/53
Molecular Structure Molecular Structure of 139-59-3 (4-Phenoxyaniline) Hazard Symbols HarmfulXn, IrritantXi
Synonyms

Aniline,p-phenoxy- (6CI,7CI,8CI);4-(Phenyloxy)aniline;4-Amino-1-phenoxybenzene;4-Aminodiphenyl ether;4-Aminophenyl phenyl ether;4-Phenoxybenzenamine;4-Phenoxyphenylamine;NSC 4629;NSC 57084;NSC 61131;p-Aminophenyl phenyl ether;p-Phenoxyaniline;p-Phenoxyphenylamine;

Article Data 92

4-Phenoxyaniline Standards and Recommendations

Handling: Wash thoroughly after handling. Do not allow water to get into the container because of violent reaction. Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage: Store in a cool, dry place. Store in a tightly closed container.

4-Phenoxyaniline Specification

The IUPAC name of this chemical is 4-phenoxyaniline. With the CAS registry number 139-59-3, it is also named as 4-Aminodiphenyl ether. The product's categories are Intermediates of Dyes and Pigments; API Intermediates. It is brown to green-brown crystalline flakes or powder.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 2.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.29; (4)ACD/LogD (pH 7.4): 2.36; (5)ACD/BCF (pH 5.5): 31.1; (6)ACD/BCF (pH 7.4): 36.53; (7)ACD/KOC (pH 5.5): 389.05; (8)ACD/KOC (pH 7.4): 456.95; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.618; (13)Molar Refractivity: 56.93 cm3; (14)Molar Volume: 162.3 cm3; (15)Polarizability: 22.56×10-24 cm3; (16)Surface Tension: 46.6 dyne/cm; (17)Enthalpy of Vaporization: 56.16 kJ/mol; (18)Vapour Pressure: 0.000327 mmHg at 25°C; (19)Rotatable Bond Count: 2; (20)Exact Mass: 185.084064; (21)MonoIsotopic Mass: 185.084064; (22)Topological Polar Surface Area: 35.2; (23)Heavy Atom Count: 14; (24)Complexity: 158.

Preparation of p-Phenoxyaniline: It can be obtained by (4-nitro-phenyl)-phenyl ether. This reaction needs reagent hydrazine monohydrate, catalyzer graphite powder (325 mesh) and solvent ethanol by heating. The reaction time is 2 hours. The yield is 87%.

Uses of p-Phenoxyaniline: It can be used as intermediate of pharmaceutical and dye. It also can react with chloroacetyl chloride to get chloro-acetic acid-(4-phenoxy-anilide). This reaction needs reagent pyridine and acetone.

When you are using this chemical, please be cautious about it as the following:
It is not only harmful if swallowed, but also irritating to eyes, respiratory system and skin. So people should avoid contact with skin. And it is very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) In addition, it should be avoided release to the environment.  

People can use the following data to convert to the molecule structure.
1. SMILES:O(c1ccccc1)c2ccc(cc2)N
2. InChI:InChI=1/C12H11NO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H,13H2

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 139-59-3