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Name |
2,6-Difluoro-3-nitrobenzoic acid |
EINECS | N/A |
CAS No. | 83141-10-0 | Density | 1.661 g/cm3 |
PSA | 83.12000 | LogP | 2.09440 |
Solubility | N/A | Melting Point |
92-96 °C |
Formula | C7H3F2NO4 | Boiling Point | 335.5 °C at 760 mmHg |
Molecular Weight | 203.102 | Flash Point | 156.7 °C |
Transport Information | N/A | Appearance | solid |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
2,6-Difluoro-3-nitrobenzoicacid;NSC 190311; |
Article Data | 15 |
This chemical is called Benzoic acid, 2,6-difluoro-3-nitro-, and its systematic name is 2,6-difluoro-3-nitrobenzoic acid. With the CAS registry number of 83141-10-0, its product categories are Blocks; Carboxes; FluoroCompounds; NitroCompounds; Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Benzene series; Benzoic acid. Additionally, this chemical should be kept cold.
Other characteristics of the Benzoic acid, 2,6-difluoro-3-nitro- can be summarised as followings: (1)ACD/LogP: 1.27; (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: 72.12 Å2; (11)Index of Refraction: 1.563; (12)Molar Refractivity: 39.71 cm3; (13)Molar Volume: 122.2 cm3; (14)Polarizability: 15.74×10-24cm3; (15)Surface Tension: 59.2 dyne/cm; (16)Density: 1.661 g/cm3; (17)Flash Point: 156.7 °C; (18)Enthalpy of Vaporization: 61.06 kJ/mol; (19)Boiling Point: 335.5 °C at 760 mmHg; (20)Vapour Pressure: 4.71E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: O=[N+]([O-])c1ccc(F)c(C(=O)O)c1F
2.InChI: InChI=1/C7H3F2NO4/c8-3-1-2-4(10(13)14)6(9)5(3)7(11)12/h1-2H,(H,11,12)
3.InChIKey: PDDHSNODMFIIRV-UHFFFAOYAK