CAS No.387824-61-5,4-AMINO-3-(TRIFLUOROMETHYL)PYRIDINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	387824-61-5
Name:	4-AMINO-3-(TRIFLUOROMETHYL)PYRIDINE

Formula:	C₆H₅F₃N₂
Molecular Weight:	162.114
Synonyms:	4-Amino-3-trifluoromethylpyridine;
EINECS:	-0
Density:	1.369 g/cm³
Melting Point:	101-102 °C
Boiling Point:	242.998 °C at 760 mmHg
Flash Point:	100.762 °C
Appearance:	white to light yellow crystal
Hazard Symbols:	T, Xi, C
Risk Codes:	23/24/25-36/37/38-43-25-34-22
Safety:	26-36/37/39-45-36/37
Transport Information:	UN 2811 6.1/PG 3
PSA:	38.91000
LogP:	2.26380

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- China (Mainland)(32)
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Specification

This chemical is called 3-(Trifluoromethyl)pyridin-4-amine, and it can also be named as 4-Pyridinamine, 3-(trifluoromethyl)-. With the molecular formula of C₆H₅F₃N₂, its molecular weight is 162.11. The CAS registry number of this chemical is 387824-61-5, and its product categories are Amines; Pyridines; Pyridine; Heterocyclic Compounds; C6; Heterocyclic Building Blocks. In addition, this chemical is white to light yellow crystal, and it should be kept cool and dry. However, this chemical should be away from the oxide.

Other characteristics of the 3-(Trifluoromethyl)pyridin-4-aminecan be summarised as followings: (1)ACD/LogP: 1.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.43; (4)ACD/LogD (pH 7.4): 1.672; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 10.332; (7)ACD/KOC (pH 5.5): 9.849; (8)ACD/KOC (pH 7.4): 172.197; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 38.91 Å²; (13)Index of Refraction: 1.479; (14)Molar Refractivity: 33.56 cm³; (15)Molar Volume: 118.448 cm³; (16)Polarizability: 13.304×10^-24cm³; (17)Surface Tension: 33.265 dyne/cm; (18)Density: 1.369 g/cm³; (19)Flash Point: 100.762 °C; (20)Enthalpy of Vaporization: 48 kJ/mol; (21)Boiling Point: 242.998 °C at 760 mmHg; (22)Vapour Pressure: 0.033 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is toxic if swallowed, and it is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of 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: c1cncc(c1N)C(F)(F)F
(2)InChI: InChI=1/C6H5F3N2/c7-6(8,9)4-3-11-2-1-5(4)10/h1-3H,(H2,10,11)
(3)InChIKey: DYAGVPKVELUYPJ-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C6H5F3N2/c7-6(8,9)4-3-11-2-1-5(4)10/h1-3H,(H2,10,11)
(5)Std. InChIKey: DYAGVPKVELUYPJ-UHFFFAOYSA-N