Benzenamine,4-phenoxy-3-(trifluoromethyl)- supplier

Name
5-AMINO-2-(PHENOXY)BENZOTRIFLUORIDE
EINECS
CAS No. 267416-81-9
Article Data3
CAS DataBase
Density 1.293 g/cm³
Solubility
Melting Point 55-57 °C
Formula C₁₃H₁₀F₃NO
Boiling Point 311.7 °C at 760 mmHg
Molecular Weight 253.224
Flash Point 142.3 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 4-Phenoxy-3-(trifluoromethyl)aniline;4-Phenoxy-3-(trifluoromethyl)benzenamine;5-Amino-2-(Phenoxy)Benzotrifluoride;
PSA 35.25000
LogP 4.66110

Benzenamine,4-phenoxy-3-(trifluoromethyl)- Specification

The Benzenamine,4-phenoxy-3-(trifluoromethyl)-, with the CAS registry number 267416-81-9, is also known as 5-Amino-2-(Phenoxy)Benzotrifluoride. This chemical's molecular formula is C₁₃H₁₀F₃NO and molecular weight is 253.22. What's more, its systematic name is 4-phenoxy-3-(trifluoromethyl)aniline.

Physical properties of Benzenamine,4-phenoxy-3-(trifluoromethyl)- are: (1)ACD/LogP: 4.28; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.27; (4)ACD/LogD (pH 7.4): 4.28; (5)ACD/BCF (pH 5.5): 1036.88; (6)ACD/BCF (pH 7.4): 1047.77; (7)ACD/KOC (pH 5.5): 4999.78; (8)ACD/KOC (pH 7.4): 5052.32; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 35.25 Å²; (13)Index of Refraction: 1.545; (14)Molar Refractivity: 61.91 cm³; (15)Molar Volume: 195.8 cm³; (16)Polarizability: 24.54×10^-24cm³; (17)Surface Tension: 36.5 dyne/cm; (18)Density: 1.293 g/cm³; (19)Flash Point: 142.3 °C; (20)Enthalpy of Vaporization: 55.26 kJ/mol; (21)Boiling Point: 311.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000555 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c2cc(N)ccc2Oc1ccccc1
(2)InChI: InChI=1S/C13H10F3NO/c14-13(15,16)11-8-9(17)6-7-12(11)18-10-4-2-1-3-5-10/h1-8H,17H2
(3)InChIKey: GLVOXGPMYXJKGS-UHFFFAOYSA-N

Product Name

5-AMINO-2-(PHENOXY)BENZOTRIFLUORIDE

Benzenamine,4-phenoxy-3-(trifluoromethyl)- Specification

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