CAS No.69695-61-0,2-CHLORO-4-(TRIFLUOROMETHOXY)ANILINE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	69695-61-0
Name:	2-CHLORO-4-(TRIFLUOROMETHOXY)ANILINE
Article Data:	2

Formula:	C₇H₅ClF₃NO
Molecular Weight:	211.571
Synonyms:	2-Chloro-4-trifluoromethoxyaniline;[2-Chloro-4-(trifluoromethoxy)phenyl]amine;
Density:	1.468g/cm³
Boiling Point:	205.8 °C at 760 mmHg
Flash Point:	78.3 °C
Appearance:	pale yellow to yellow-brown liquid
Hazard Symbols:	T; Xn; Xi
Risk Codes:	22-43-36/37/38
Safety:	26-36-37/39
PSA:	35.25000
LogP:	3.40200

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Specification

The Benzenamine,2-chloro-4-(trifluoromethoxy)-, with CAS registry number 69695-61-0, belongs to the following product categories: (1)Anilines, Aromatic Amines and Nitro Compounds; (2)Amines; (3)C7; (4)Nitrogen Compounds. It has the systematic name of 2-chloro-4-(trifluoromethoxy)aniline. This chemical is a kind of pale yellow to yellow-brown liquid. And this chemical should be stored at the temperature of 2-8°C.

Physical properties of Benzenamine,2-chloro-4-(trifluoromethoxy)-: (1)ACD/LogP: 2.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.98; (4)ACD/LogD (pH 7.4): 2.98; (5)ACD/BCF (pH 5.5): 109.25; (6)ACD/BCF (pH 7.4): 109.27; (7)ACD/KOC (pH 5.5): 1001.56; (8)ACD/KOC (pH 7.4): 1001.75; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 12.47 Å²; (13)Index of Refraction: 1.502; (14)Molar Refractivity: 42.51 cm³; (15)Molar Volume: 144 cm³; (16)Polarizability: 16.85×10^-24cm³; (17)Surface Tension: 34.5 dyne/cm; (18)Enthalpy of Vaporization: 44.21 kJ/mol; (19)Vapour Pressure: 0.245 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Benzenamine,2-chloro-4-(trifluoromethoxy)- irritates to eyes, respiratory system and skin. This chemical may cause sensitization by skin contact and is harmful if swallowed. When use it, wear suitable protective clothing, gloves and eye/face protection. If 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: Clc1cc(OC(F)(F)F)ccc1N
(2)InChI: InChI=1/C7H5ClF3NO/c8-5-3-4(1-2-6(5)12)13-7(9,10)11/h1-3H,12H2
(3)InChIKey: YMLWONHDNGICOH-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C7H5ClF3NO/c8-5-3-4(1-2-6(5)12)13-7(9,10)11/h1-3H,12H2
(5)Std. InChIKey: YMLWONHDNGICOH-UHFFFAOYSA-N