CAS No.239135-49-0,2-Fluoro-3-(trifluoromethyl)benzylamine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	239135-49-0
Name:	2-Fluoro-3-(trifluoromethyl)benzylamine

Formula:	C₈H₇F₄N
Molecular Weight:	193.144
Synonyms:	2-Fluoro-3-(trifluoromethyl)benzylamine;
Density:	1.312 g/cm³
Boiling Point:	187.4 °C at 760 mmHg
Flash Point:	79.6 °C
Solubility:	Not miscible or difficult to mix in water.
Hazard Symbols:	C,Xi
Risk Codes:	34-36/37/38
Safety:	26-36/37/39-45
PSA:	26.02000
LogP:	3.00350

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Specification

The Benzenemethanamine,2-fluoro-3-(trifluoromethyl)-, with the CAS registry number 239135-49-0, is also known as 2-Fluoro-3-(trifluoromethyl)benzylamine. This chemical's molecular formula is C₈H₇F₄N and molecular weight is 193.141493. Its IUPAC name is called [2-fluoro-3-(trifluoromethyl)phenyl]methanamine.

Physical properties of Benzenemethanamine,2-fluoro-3-(trifluoromethyl)-: (1)ACD/LogP: 1.74; (2)ACD/LogD (pH 5.5): -1.08; (3)ACD/LogD (pH 7.4): 0.48; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 11.6; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.451; (12)Molar Refractivity: 39.67 cm³; (13)Molar Volume: 147.1 cm³; (14)Surface Tension: 27.6 dyne/cm; (15)Density: 1.312 g/cm³; (16)Flash Point: 79.6 °C; (17)Enthalpy of Vaporization: 42.36 kJ/mol; (18)Boiling Point: 187.4 °C at 760 mmHg; (19)Vapour Pressure: 0.633 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may destroy living tissue on contact. It may cause inflammation to the skin or other mucous membranes. Besides, 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. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C(=C1)C(F)(F)F)F)CN
(2)InChI: InChI=1S/C8H7F4N/c9-7-5(4-13)2-1-3-6(7)8(10,11)12/h1-3H,4,13H2
(3)InChIKey: PQUYJDPJHOSOTN-UHFFFAOYSA-N