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| CAS No.: | 15366-63-9 |
|---|---|
| Name: | 4-IODONICOTINIC ACID |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C6H4INO2 |
| Molecular Weight: | 249.008 |
| Synonyms: | Nicotinicacid, 4-iodo- (8CI);4-Iodo-3-pyridinecarboxylic acid; |
| Density: | 2.123 g/cm3 |
| Boiling Point: | 350 °C at 760 mmHg |
| Flash Point: | 165.5 °C |
| PSA: | 50.19000 |
| LogP: | 1.38440 |
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- Total:14 Page 1 of 1 1
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Specification
The 3-Pyridinecarboxylicacid, 4-iodo-, with the CAS registry number 15366-63-9, is also known as 4-Iodonicotinic acid. It belongs to the product category of Pyridines. This chemical's molecular formula is C6H4INO2 and molecular weight is 249.0059. Its systematic name is called 4-iodopyridine-3-carboxylic acid.
Physical properties of 3-Pyridinecarboxylicacid, 4-iodo-: (1)ACD/LogP: 0.42; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.677; (10)Molar Refractivity: 44.18 cm3; (11)Molar Volume: 117.2 cm3; (12)Surface Tension: 69.9 dyne/cm; (13)Density: 2.123 g/cm3; (14)Flash Point: 165.5 °C; (15)Enthalpy of Vaporization: 62.74 kJ/mol; (16)Boiling Point: 350 °C at 760 mmHg; (17)Vapour Pressure: 1.69E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Ic1ccncc1C(=O)O
(2)InChI: InChI=1/C6H4INO2/c7-5-1-2-8-3-4(5)6(9)10/h1-3H,(H,9,10)
(3)InChIKey: XAPIMMBHYWWKAE-UHFFFAOYAT