CAS No.58481-10-0,2-IODO-ISONICOTINIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	58481-10-0
Name:	2-IODO-ISONICOTINIC ACID

Formula:	C₆H₄INO₂
Molecular Weight:	249.008
Synonyms:	2-Iodoisonicotinicacid;
EINECS:	-0
Density:	2.124 g/cm³
Melting Point:	210-220 °C
Boiling Point:	466.545 °C at 760 mmHg
Flash Point:	235.958 °C
Hazard Symbols:	Xi
PSA:	50.19000
LogP:	1.38440

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Specification

This chemical is called 2-Iodoisonicotinic acid, and its systematic name is 2-iodopyridine-4-carboxylic acid. With the molecular formula of C₆H₄INO₂, its molecular weight is 249.01. The CAS registry number of this chemical is 58481-10-0. Additionally, its product category is Pyridine.

Other characteristics of the 2-Iodoisonicotinic acid can be summarised as followings: (1)ACD/LogP: 1.53; (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: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 50.19 Å²; (11)Index of Refraction: 1.677; (12)Molar Refractivity: 44.181 cm³; (13)Molar Volume: 117.26 cm³; (14)Polarizability: 17.515×10^-24cm³; (15)Surface Tension: 69.987 dyne/cm; (16)Density: 2.124 g/cm³; (17)Flash Point: 235.958 °C; (18)Enthalpy of Vaporization: 76.738 kJ/mol; (19)Boiling Point: 466.545 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)c1ccnc(I)c1
2.InChI: InChI=1/C6H4INO2/c7-5-3-4(6(9)10)1-2-8-5/h1-3H,(H,9,10)
3.InChIKey: FALCXGCLOUKBSP-UHFFFAOYAX