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6-Chloropyridazine-3-carboxamide

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Name

6-Chloropyridazine-3-carboxamide

EINECS N/A
CAS No. 66346-83-6 Density 1.479 g/cm3
PSA 68.87000 LogP 0.92920
Solubility N/A Melting Point N/A
Formula C5H4ClN3O Boiling Point 424.641 °C at 760 mmHg
Molecular Weight 157.559 Flash Point 210.616 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 66346-83-6 (6-Chloropyridazine-3-carboxamide) Hazard Symbols IrritantXi
Synonyms

3-pyridazinecarboxamide, 6-chloro-;6-Chloro-3-pyridazinecarboxamide;

Article Data 9

6-Chloropyridazine-3-carboxamide Specification

The 6-Chloropyridazine-3-carboxamide with the CAS number 66346-83-6 is also called 3-pyridazinecarboxamide, 6-chloro-. Its molecular formula is C5H4ClN3O. The product category is Pyrazines, Pyrimidines & Pyridazines. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 0.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 35; (8)ACD/KOC (pH 7.4): 35; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 68.87 Å2; (13)Index of Refraction: 1.596; (14)Molar Refractivity: 36.261 cm3; (15)Molar Volume: 106.533 cm3; (16)Polarizability: 14.375×10-24cm3; (17)Surface Tension: 67.954 dyne/cm; (18)Enthalpy of Vaporization: 67.916 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(nn1)C(=O)N
(2)InChI: InChI=1/C5H4ClN3O/c6-4-2-1-3(5(7)10)8-9-4/h1-2H,(H2,7,10)
(3)InChIKey: NMCKZYHQHAZHIO-UHFFFAOYAT

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