2,6-Difluoro-4-nitroanisole supplier

Name
2,6-DIFLUORO-4-NITROANISOLE
EINECS
CAS No. 392-25-6
Article Data12
CAS DataBase
Density 1.414g/cm³
Solubility
Melting Point
Formula C₇H₅F₂NO₃
Boiling Point 280.4 °C at 760 mmHg
Molecular Weight 189.118
Flash Point 123.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols T
Synonyms Anisole,2,6-difluoro-4-nitro- (8CI);1,3-Difluoro-2-methoxy-5-nitrobenzene;2,6-Difluoro-4-nitroanisole;
PSA 55.05000
LogP 2.40480

2,6-Difluoro-4-nitroanisole Specification

The 2,6-Difluoro-4-nitroanisole, with cas registry number 392-25-6, has the systematic name of 1,3-difluoro-2-methoxy-5-nitrobenzene. And it is also called benzene, 1,3-difluoro-2-methoxy-5-nitro-.

Physical properties about this chemical are: (1)ACD/LogP: 1.87; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.87; (4)ACD/LogD (pH 7.4): 1.87; (5)ACD/BCF (pH 5.5): 15.56; (6)ACD/BCF (pH 7.4): 15.56; (7)ACD/KOC (pH 5.5): 248.19; (8)ACD/KOC (pH 7.4): 248.19; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 55.05 Å²; (13)Index of Refraction: 1.502; (14)Molar Refractivity: 39.46 cm³; (15)Molar Volume: 133.6 cm³; (16)Polarizability: 15.64×10^-24cm³; (17)Surface Tension: 38.7 dyne/cm; (18)Enthalpy of Vaporization: 49.82 kJ/mol; (19)Vapour Pressure: 0.00646 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(cc(F)c1OC)[N+]([O-])=O
(2)InChI: InChI=1/C7H5F2NO3/c1-13-7-5(8)2-4(10(11)12)3-6(7)9/h2-3H,1H3
(3)InChIKey: HHWLNWSVKHLZDB-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C7H5F2NO3/c1-13-7-5(8)2-4(10(11)12)3-6(7)9/h2-3H,1H3
(5)Std. InChIKey: HHWLNWSVKHLZDB-UHFFFAOYSA-N

Product Name

2,6-DIFLUORO-4-NITROANISOLE

2,6-Difluoro-4-nitroanisole Specification

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