3-Fluoro-2-nitroaniline supplier

Name
3-FLUORO-2-NITROANILINE
EINECS
CAS No. 567-63-5
Density 1.448 g/cm³
Solubility
Melting Point
Formula C₆H₅FN₂O₂
Boiling Point 305.7 °C at 760 mmHg
Molecular Weight 156.11
Flash Point 138.7 °C
Transport Information
Appearance
Safety 26-36/37/39-45
Risk Codes 34
Molecular Structure
Hazard Symbols Xi
Synonyms Aniline,3-fluoro-2-nitro- (8CI);3-Fluoro-2-nitroaniline;
PSA 71.84000
LogP 2.42050

3-Fluoro-2-nitroaniline Specification

The Benzenamine,3-fluoro-2-nitro-, with CAS registry number 567-63-5, has the systematic name of 3-fluoro-2-nitroaniline. Besides this, it is also called Aniline,3-fluoro-2-nitro- (8CI). Its molecular weight is 156.11. And the chemical formula of this chemical is C₆H₅FN₂O₂.

Physical properties of Benzenamine,3-fluoro-2-nitro-: (1)ACD/LogP: 1.97; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.97; (4)ACD/LogD (pH 7.4): 1.97; (5)ACD/BCF (pH 5.5): 18.5; (6)ACD/BCF (pH 7.4): 18.5; (7)ACD/KOC (pH 5.5): 280.96; (8)ACD/KOC (pH 7.4): 280.96; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 49.06 Å²; (13)Index of Refraction: 1.603; (14)Molar Refractivity: 37.02 cm³; (15)Molar Volume: 107.7 cm³; (16)Polarizability: 14.67×10^-24cm³; (17)Surface Tension: 56.7 dyne/cm; (18)Density: 1.448 g/cm³; (19)Flash Point: 138.7 °C; (20)Enthalpy of Vaporization: 54.61 kJ/mol; (21)Boiling Point: 305.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000809 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1c(F)cccc1N
(2)InChI: InChI=1/C6H5FN2O2/c7-4-2-1-3-5(8)6(4)9(10)11/h1-3H,8H2
(3)InChIKey: NSFGNLQLWFZHKK-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C6H5FN2O2/c7-4-2-1-3-5(8)6(4)9(10)11/h1-3H,8H2
(5)Std. InChIKey: NSFGNLQLWFZHKK-UHFFFAOYSA-N

Product Name

3-FLUORO-2-NITROANILINE

3-Fluoro-2-nitroaniline Specification

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