CAS No.261944-56-3,5-Amino-2,4-difluorobenzotrifluoride Suppliers

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Basic Information

Molecular Structure:
CAS No.:	261944-56-3
Name:	5-Amino-2,4-difluorobenzotrifluoride

Formula:	C₇H₄F₅N
Molecular Weight:	197.107
Synonyms:	2,4-Difluoro-5-trifluoromethylaniline;
Density:	1.475 g/cm³
Boiling Point:	180.557 °C at 760 mmHg
Flash Point:	72.83 °C
Hazard Symbols:	T
Risk Codes:	20/21/22
Safety:	26-36/37/39-45
Transport Information:	UN 2810
PSA:	26.02000
LogP:	3.14700

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Specification

This chemical is called Benzenamine, 2,4-difluoro-5-(trifluoromethyl)-, and its systematic name is 2,4-difluoro-5-(trifluoromethyl)aniline. With the molecular formula of C₇H₄F₅N, its molecular weight is 197.11. The CAS registry number of this chemical is 261944-56-3.

Other characteristics of the Benzenamine, 2,4-difluoro-5-(trifluoromethyl)- can be summarised as followings: (1)ACD/LogP: 3.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.11; (4)ACD/LogD (pH 7.4): 3.11; (5)ACD/BCF (pH 5.5): 137.02; (6)ACD/BCF (pH 7.4): 137.06; (7)ACD/KOC (pH 5.5): 1177.79; (8)ACD/KOC (pH 7.4): 1178.19; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å²; (13)Index of Refraction: 1.443; (14)Molar Refractivity: 35.45 cm³; (15)Molar Volume: 133.6 cm³; (16)Polarizability: 14.05×10^-24cm³; (17)Surface Tension: 26.9 dyne/cm; (18)Density: 1.474 g/cm³; (19)Flash Point: 72.8 °C; (20)Enthalpy of Vaporization: 41.68 kJ/mol; (21)Boiling Point: 180.6 °C at 760 mmHg; (22)Vapour Pressure: 0.89 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is harmful by inhalation, in contacting with skin and if swallowed. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: Fc1c(cc(N)c(F)c1)C(F)(F)F
2.InChI: InChI=1/C7H4F5N/c8-4-2-5(9)6(13)1-3(4)7(10,11)12/h1-2H,13H2
3.InChIKey: FFQALBCXGPYQGT-UHFFFAOYAK