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Phenol,2,3,5-trifluoro- (2268-15-7)

Identification
Name:Phenol,2,3,5-trifluoro-
Synonyms:2,3,5-Trifluorophenol;
CAS:2268-15-7
Molecular Formula: C6H3F3O
Molecular Weight: 148.08
InChI: InChI=1S/C6H3F3O/c7-3-1-4(8)6(9)5(10)2-3/h1-2,10H
Molecular Structure: (C6H3F3O) 2,3,5-Trifluorophenol;
Properties
Transport:UN 1325
Melting Point: 29 °C(lit.)
Flash Point: 54 ºC
Boiling Point: 57 °C29 mm Hg(lit.)
Density:1.457
Refractive index:1.462
Appearance:clear light yellow liquid after melting
Specification:

The CAS register number of 2,3,5-Trifluorophenol is 2268-15-7. It also can be called as Phenol,2,3,5-trifluoro- and the IUPAC name about this chemical is 2,3,5-trifluorophenol. The molecular formula about this chemical is C6H3F3O and molecular weight is 148.08.

Physical properties about 2,3,5-Trifluorophenol are: (1)ACD/LogP: 2.62; (2)ACD/LogD (pH 5.5): 2.6; (3)ACD/LogD (pH 7.4): 1.86; (4)ACD/BCF (pH 5.5): 54.52; (5)ACD/BCF (pH 7.4): 9.95; (6)ACD/KOC (pH 5.5): 598.91; (7)ACD/KOC (pH 7.4): 109.25; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 9.23Å2; (12)Index of Refraction: 1.471; (13)Molar Refractivity: 28.11 cm3; (14)Molar Volume: 100.4 cm3; (15)Polarizability: 11.14x10-24cm3; (16)Surface Tension: 34.5 dyne/cm; (17)Enthalpy of Vaporization: 39.41 kJ/mol; (18)Boiling Point: 141.3 °C at 760 mmHg; (19)Vapour Pressure: 4.71 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 contact with skin and if swallowed and it is irritating to eyes, respiratory system and skin, it is also Flammable. When you are using it, wear suitable protective clothing, gloves and eye/face protection, you also need keep away from sources of ignition and take off immediately all contaminated clothing. After contact with skin, wash immediately with plenty of soap-suds. 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: Fc1cc(F)cc(O)c1F
(2)InChI: InChI=1/C6H3F3O/c7-3-1-4(8)6(9)5(10)2-3/h1-2,10H
(3)InChIKey: JNZQXSIWHRRMNO-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C6H3F3O/c7-3-1-4(8)6(9)5(10)2-3/h1-2,10H
(5)Std. InChIKey: JNZQXSIWHRRMNO-UHFFFAOYSA-N

Packinggroup: III
HS Code: 29081000
Flash Point: 54 ºC
Storage Temperature: Flammables area
Safety Data
Hazard Symbols Xn: Harmful