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| CAS No.: | 78238-14-9 |
|---|---|
| Name: | 3-HYDROXY-5-NITROBENZOIC ACID |
| Article Data: | 10 |
| Molecular Structure: | |
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| Formula: | C7H5NO5 |
| Molecular Weight: | 183.12 |
| Synonyms: | 3-Hydroxy-5-nitrobenzoicacid;3-Nitro-5-hydroxybenzoic acid;5-Hydroxy-3-nitrobenzoic acid; |
| Density: | 1.631 g/cm3 |
| Melting Point: | 190-195℃ |
| Boiling Point: | 423.5 °C at 760 mmHg |
| Flash Point: | 195.3 °C |
| Hazard Symbols: | Xn |
| Risk Codes: | 22-36/37/38 |
| Safety: | 26-36 |
| PSA: | 103.35000 |
| LogP: | 1.52180 |
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- Total:30 Page 1 of 1 1
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Specification
The 3-Hydroxy-5-nitrobenzoic acid is an organic compound with the formula C7H5NO5. The systematic name of this chemical is 3-hydroxy-5-nitrobenzoic acid. With the CAS registry number 78238-14-9, it is also named as benzoic acid, 3-hydroxy-5-nitro-. The product's categories are Aromatic Carboxylic Acids; Amides; Anilides; Anhydrides & Salts.
Physical properties about 3-Hydroxy-5-nitrobenzoic acid are: (1)ACD/LogP: 2.14; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 2.14; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 6; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 81.35 Å2; (10)Index of Refraction: 1.663; (11)Molar Refractivity: 41.61 cm3; (12)Molar Volume: 112.2 cm3; (13)Polarizability: 16.49×10-24cm3; (14)Surface Tension: 84.1 dyne/cm; (15)Density: 1.631 g/cm3; (16)Flash Point: 195.3 °C; (17)Enthalpy of Vaporization: 71.46 kJ/mol; (18)Boiling Point: 423.5 °C at 760 mmHg; (19)Vapour Pressure: 6.27E-08 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1cc(cc(O)c1)C(=O)O
(2)InChI: InChI=1/C7H5NO5/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3,9H,(H,10,11)
(3)InChIKey: ZVLLYIMPDTXFNC-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C7H5NO5/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3,9H,(H,10,11)
(5)Std. InChIKey: ZVLLYIMPDTXFNC-UHFFFAOYSA-N