2,3,6-Trifluoroanisole supplier

Name
2,3,6-TRIFLUOROANISOLE
EINECS -0
CAS No. 4920-34-7
Article Data4
CAS DataBase
Density 1.285 g/cm³
Solubility
Melting Point
Formula C₇H₅F₃O
Boiling Point 147.7 °C at 760 mmHg
Molecular Weight 162.11
Flash Point 49.1 °C
Transport Information 1993
Appearance
Safety 16
Risk Codes 10
Molecular Structure
Hazard Symbols F
Synonyms Anisole,2,3,6-trifluoro- (7CI,8CI);2,3,6-Trifluoroanisole;2,5,6-Trifluoroanisole;
PSA 9.23000
LogP 2.11250

2,3,6-Trifluoroanisole Specification

The CAS register number of 2,3,6-Trifluoroanisole is 4920-34-7. It also can be called as 3-Methoxy-1,2,4-trifluorobenzene and the IUPAC name about this chemical is 1,2,4-trifluoro-3-methoxybenzene. The molecular formula about this chemical is C₇H₅F₃O and molecular weight is 162.11. It belongs to the Aromatic Ethers. This chemical is flammable. When you are using it, please keep away from sources of ignition.

Physical properties about 2,3,6-Trifluoroanisole are: (1)ACD/LogP: 2.25; (2)ACD/LogD (pH 5.5): 2.25; (3)ACD/LogD (pH 7.4): 2.25; (4)ACD/BCF (pH 5.5): 30.41; (5)ACD/BCF (pH 7.4): 30.41; (6)ACD/KOC (pH 5.5): 401.05; (7)ACD/KOC (pH 7.4): 401.05; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 9.23Å²; (11)Index of Refraction: 1.435; (12)Molar Refractivity: 32.91 cm³; (13)Molar Volume: 126 cm³; (14)Polarizability: 13.04x10^-24cm³; (15)Surface Tension: 26.2 dyne/cm; (16)Enthalpy of Vaporization: 36.88 kJ/mol; (17)Boiling Point: 147.7 °C at 760 mmHg; (18)Vapour Pressure: 5.53 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(F)ccc(F)c1OC
(2)InChI: InChI=1/C7H5F3O/c1-11-7-5(9)3-2-4(8)6(7)10/h2-3H,1H3
(3)InChIKey: MLDVKASVEXYFKX-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C7H5F3O/c1-11-7-5(9)3-2-4(8)6(7)10/h2-3H,1H3
(5)Std. InChIKey: MLDVKASVEXYFKX-UHFFFAOYSA-N

Product Name

2,3,6-TRIFLUOROANISOLE

2,3,6-Trifluoroanisole Specification

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