2-Fluoro-6-nitroaniline supplier

Name
2-FLUORO-6-NITRO-PHENYLAMINE
EINECS 241-779-9
CAS No. 17809-36-8
Article Data15
CAS DataBase
Density 1.448 g/cm³
Solubility
Melting Point 74-75 °C
Formula C₆H₅FN₂O₂
Boiling Point 271.5 °C at 760 mmHg
Molecular Weight 156.116
Flash Point 118 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Aniline,2-fluoro-6-nitro- (8CI);6-Fluoro-2-nitroaniline;2-Fluoro-6-nitro-phenylamine;
PSA 71.84000
LogP 2.42050

2-Fluoro-6-nitroaniline Specification

The Benzenamine, 2-fluoro-6-nitro-, with the CAS registry number 17809-36-8 and EINECS registry number 241-779-9, has the systematic name and IUPAC name of 2-fluoro-6-nitroaniline. It belongs to the product categories of Miscellaneous and Benzenes. And the molecular formula of the chemical is C₆H₅FN₂O₂.

The characteristics of Benzenamine, 2-fluoro-6-nitro- are as followings: (1)ACD/LogP: 2.07; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.07; (4)ACD/LogD (pH 7.4): 2.07; (5)ACD/BCF (pH 5.5): 21.91; (6)ACD/BCF (pH 7.4): 21.91; (7)ACD/KOC (pH 5.5): 317.12; (8)ACD/KOC (pH 7.4): 317.12; (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: 118 °C; (20)Enthalpy of Vaporization: 50.97 kJ/mol; (21)Boiling Point: 271.5 °C at 760 mmHg; (22)Vapour Pressure: 0.00644 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Fc1cccc([N+]([O-])=O)c1N
(2)InChI: InChI=1/C6H5FN2O2/c7-4-2-1-3-5(6(4)8)9(10)11/h1-3H,8H2
(3)InChIKey: BHWHYGWMNMCXBA-UHFFFAOYAB

Product Name

2-FLUORO-6-NITRO-PHENYLAMINE

2-Fluoro-6-nitroaniline Specification

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