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2-Oxazolamine,4-(trifluoromethyl)- (35629-71-1)

Identification
Name:2-Oxazolamine,4-(trifluoromethyl)-
Synonyms:Oxazole,2-amino-4-(trifluoromethyl)- (8CI);(4-Trifluoromethyloxazol-2-yl)amine;2-Amino-4-(trifluoromethyl)oxazole;4-(Trifluoromethyl)-1,3-oxazol-2-amine;4-(Trifluoromethyl)-2-oxazolamine;
CAS:35629-71-1
Molecular Formula: C4H3F3N2O
Molecular Weight: 152.07
InChI: InChI=1/C7H5F7O2/c1-3(15)2-4(16)5(8,9)6(10,11)7(12,13)14/h2H2,1H3
Molecular Structure: (C4H3F3N2O) Oxazole,2-amino-4-(trifluoromethyl)- (8CI);(4-Trifluoromethyloxazol-2-yl)amine;2-Amino-4-(trifluorom...
Properties
Flash Point: 64.7°C
Boiling Point: 183.4°Cat760mmHg
Density:1.502g/cm3
Refractive index:1.325
Specification:

The 2-Amino-4-(trifluoromethyl)oxazole is an organic compound with the formula C4H3F3N2O. The IUPAC name of this chemical is 4-(trifluoromethyl)-1,3-oxazol-2-amine. With the CAS registry number 35629-71-1, it is also named as 4-Trifluoromethyl-oxazol-2-ylamine. The product's categories are Amines; Oxazoles, Isoxazoles & Benzoxazoles.

Physical properties about 2-Amino-4-(trifluoromethyl)oxazole are: (1)ACD/LogP: 0.20; (2)ACD/LogD (pH 5.5): 0.201; (3)ACD/LogD (pH 7.4): 0.201; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 30.635; (7)ACD/KOC (pH 7.4): 30.645; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)Polar Surface Area: 52.05 Å2; (11)Index of Refraction: 1.424; (12)Molar Refractivity: 25.86 cm3; (13)Molar Volume: 101.242 cm3; (14)Polarizability: 10.252×10-24cm3; (15)Surface Tension: 30.767 dyne/cm; (16)Density: 1.502 g/cm3; (17)Flash Point: 64.742 °C; (18)Enthalpy of Vaporization: 41.968 kJ/mol; (19)Boiling Point: 183.438 °C at 760 mmHg; (20)Vapour Pressure: 0.771 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. 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: c1c(nc(o1)N)C(F)(F)F
(2)InChI: InChI=1/C4H3F3N2O/c5-4(6,7)2-1-10-3(8)9-2/h1H,(H2,8,9)
(3)InChIKey: LUSFWEXIRSHBNN-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C4H3F3N2O/c5-4(6,7)2-1-10-3(8)9-2/h1H,(H2,8,9)
(5)Std. InChIKey: LUSFWEXIRSHBNN-UHFFFAOYSA-N

Flash Point: 64.7°C
Safety Data
Hazard Symbols Xi: Irritant F: Flammable