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77326-45-5

Basic Information
CAS No.: 77326-45-5
Name: 2-Aminocarbonyl-3-nitrobenzoic acid
Article Data: 20
Molecular Structure:
Molecular Structure of 77326-45-5 (2-Aminocarbonyl-3-nitrobenzoic acid)
Formula: C8H6N2O5
Molecular Weight: 210.146
Synonyms: 2-(Aminocarbonyl)-3-nitrobenzoicacid;3-Nitrophthalamic acid;NSC 519708;
Density: 1.585 g/cm3
Boiling Point: 398.5 °C at 760 mmHg
Flash Point: 194.8 °C
PSA: 126.21000
LogP: 1.61540
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    Benzoic acid, 2-(aminocarbonyl)-3-nitro-; 2-CARBAMOYL-3-NITROBENZOIC ACID; 2-Aminocarbonyl-3-nitrobenzoic acid; 3-Nitro-phthalamic acid CAS No.: 77326-45-5 Molecular formula: C8H6N2O5 Molecular weight: 210.14 PSA: 126.21000 LogP: 1.

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Specification

The 2-Aminocarbonyl-3-nitrobenzoic acid is a kind of aromatics with the fomular C8H6N2O5. The systematic name of this product is 2-carbamoyl-3-nitrobenzoic acid . With the CAS registry number 77326-45-5, it is also named as Benzoic acid, 2-(aminocarbonyl)-3-nitro- ; 2-(Aminocarbonyl)-3-nitrobenzoic acid . 2-Aminocarbonyl-3-nitrobenzoic acid can be used as drug intermediates. 

The other characteristics of this product can be summarized as: (1)ACD/BCF (pH 5.5): 1 ; (2)ACD/BCF (pH 7.4): 1 ; (3)ACD/KOC (pH 5.5): 1 ; (4)ACD/KOC (pH 7.4): 1 ; (5)#H bond acceptors: 7 ; (6)#H bond donors: 3 ; (7)#Freely Rotating Bonds: 3 ; (8)Index of Refraction: 1.655 ; (9)Molar Refractivity: 48.65 cm3 ; (10)Molar Volume: 132.5 cm3 ; (11)Polarizability: 19.28×10-24cm3 ; (12)Surface Tension: 82.4 dyne/cm ; (13)Enthalpy of Vaporization: 68.46 kJ/mol ; (14)Vapour Pressure: 4.57E-07 mmHg at 25°C. 

People can use the following data to convert to the molecule structure. SMILES: O=[N+]([O-])c1cccc(c1C(=O)N)C(=O)O; InChI: InChI=1/C8H6N2O5/c9-7(11)6-4(8(12)13)2-1-3-5(6)10(14)15/h1-3H,(H2,9,11)(H,12,13). 2-Aminocarbonyl-3-nitrobenzoic acid has many suppliers, such as Nanjing Feihe Pharma Tech Co., Ltd..