2-Fluoro-3-nitrobenzoic acid supplier

Name
2-FLUORO-3-NITROBENZOIC ACID
EINECS 630-017-4
CAS No. 317-46-4
Article Data8
CAS DataBase
Density 1.568 g/cm³
Solubility Slightly soluble in water.
Melting Point
Formula C₇H₄FNO₄
Boiling Point 347.6 °C at 760 mmHg
Molecular Weight 185.111
Flash Point 164 °C
Transport Information
Appearance
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Fluoro-3-nitrobenzoicacid;benzoic acid, 2-fluoro-3-nitro-;
PSA 83.12000
LogP 1.95530

2-Fluoro-3-nitrobenzoic acid Specification

The 2-Fluoro-3-nitrobenzoic acid, with the CAS registry number 317-46-4, has the systematic name of 2-fluoro-3-nitrobenzoic acid. And the molecular formula of this chemical is C₇H₄FNO₄. It is a kind of air sensitive chemical, and belongs to the following product categories: Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts.

The physical properties of 2-Fluoro-3-nitrobenzoic acid are as following: (1)ACD/LogP: 1.47; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 5; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 83.12 Å²; (11)Index of Refraction: 1.588; (12)Molar Refractivity: 39.72 cm³; (13)Molar Volume: 118 cm³; (14)Polarizability: 15.74×10^-24cm³; (15)Surface Tension: 62.6 dyne/cm; (16)Density: 1.568 g/cm³; (17)Flash Point: 164 °C; (18)Enthalpy of Vaporization: 62.46 kJ/mol; (19)Boiling Point: 347.6 °C at 760 mmHg; (20)Vapour Pressure: 2.01E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=N(=O)c1cccc(C(O)=O)c1F
(2)InChI: InChI=1/C7H4FNO4/c8-6-4(7(10)11)2-1-3-5(6)9(12)13/h1-3H,(H,10,11)
(3)InChIKey: WLGUSLGYTNJJFV-UHFFFAOYAX

Product Name

2-FLUORO-3-NITROBENZOIC ACID

2-Fluoro-3-nitrobenzoic acid Specification

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