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2,4-Difluoro-5-nitrobenzoic acid

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Name

2,4-Difluoro-5-nitrobenzoic acid

EINECS N/A
CAS No. 153775-33-8 Density 1.661 g/cm3
PSA 83.12000 LogP 2.09440
Solubility N/A Melting Point 116-120 °C
Formula C7H3F2NO4 Boiling Point 344.4 °C at 760 mmHg
Molecular Weight 203.102 Flash Point 162.1 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 153775-33-8 (2,4-Difluoro-5-nitrobenzoic acid) Hazard Symbols IrritantXi
Synonyms

2,4-Difluoro-5-nitrobenzoicacid;

Article Data 10

2,4-Difluoro-5-nitrobenzoic acid Specification

The 2,4-Difluoro-5-nitrobenzoic acid, with the CAS registry number 153775-33-8, is also known as 2,4-Difluoro-5-nitrobenzoic acid 98%. It belongs to the product categories of Blocks; Carboxes; FluoroCompounds; NitroCompounds. This chemical's molecular formula is C7H3F2NO4 and molecular weight is 203.0998. Its IUPAC name is called 2,4-difluoro-5-nitrobenzoate.

Physical properties of 2,4-Difluoro-5-nitrobenzoic acid: (1)ACD/LogP: 1.49; (2)ACD/LogD (pH 5.5): -1.19; (3)ACD/LogD (pH 7.4): -1.65; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 5; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.563; (12)Molar Refractivity: 39.71 cm3; (13)Molar Volume: 122.2 cm3; (14)Surface Tension: 59.2 dyne/cm; (15)Density: 1.661 g/cm3; (16)Flash Point: 162.1 °C; (17)Enthalpy of Vaporization: 62.09 kJ/mol; (18)Boiling Point: 344.4 °C at 760 mmHg; (19)Vapour Pressure: 2.52E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=C(C(=CC(=C1[N+](=O)[O-])F)F)C(=O)[O-]
(2)InChI: InChI=1S/C7H3F2NO4/c8-4-2-5(9)6(10(13)14)1-3(4)7(11)12/h1-2H,(H,11,12)/p-1
(3)InChIKey: MDFSGDMPHMKKGB-UHFFFAOYSA-M

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