CAS No.88912-25-8,4,6-Dichloro-2-pyridinecarboxylic acid Suppliers

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Basic Information

Molecular Structure:
CAS No.:	88912-25-8
Name:	4,6-Dichloro-2-pyridinecarboxylic acid

Formula:	C₆H₃Cl₂NO₂
Molecular Weight:	192.001
Synonyms:	4,6-Dichloro-2-pyridinecarboxylic acid;Picolinicacid, 4,6-dichloro- (6CI);
Density:	1.612g/cm³
Melting Point:	111-112 °C
Boiling Point:	336.6 °C at 760 mmHg
Flash Point:	157.4 °C
PSA:	50.19000
LogP:	2.08660

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Specification

The 2-Pyridinecarboxylicacid, 4,6-dichloro-, with CAS registry number 88912-25-8, belongs to the following product category: Pharmacetical. It has the systematic name of 4,6-dichloropyridine-2-carboxylic acid. Besides this, it is also called 4,6-Dichloropicolinic acid. And the chemical formula of this chemical is C₆H₃Cl₂NO₂.

Physical properties of 2-Pyridinecarboxylicacid, 4,6-dichloro-: (1)ACD/LogP: 1.86; (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: 1.605; (12)Molar Refractivity: 41.06 cm³; (13)Molar Volume: 119 cm³; (14)Polarizability: 16.27×10^-24cm³; (15)Surface Tension: 62.8 dyne/cm; (16)Density: 1.612 g/cm³; (17)Flash Point: 157.4 °C; (18)Enthalpy of Vaporization: 61.2 kJ/mol; (19)Boiling Point: 336.6 °C at 760 mmHg; (20)Vapour Pressure: 4.34E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(nc(Cl)c1)C(O)=O
(2)InChI: InChI=1/C6H3Cl2NO2/c7-3-1-4(6(10)11)9-5(8)2-3/h1-2H,(H,10,11)
(3)InChIKey: AYYUSDKNXRPJBH-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C6H3Cl2NO2/c7-3-1-4(6(10)11)9-5(8)2-3/h1-2H,(H,10,11)
(5)Std. InChIKey: AYYUSDKNXRPJBH-UHFFFAOYSA-N