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N-(6-Chloro-3-pyridazinyl)acetamide

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Name

N-(6-Chloro-3-pyridazinyl)acetamide

EINECS N/A
CAS No. 14959-31-0 Density 1.419g/cm3
PSA 54.88000 LogP 1.16140
Solubility N/A Melting Point 250 °C (decomp)
Formula C6H6ClN3O Boiling Point 461.8 °C at 760 mmHg
Molecular Weight 171.586 Flash Point 233.1 °C
Transport Information N/A Appearance Colorless transparent liquid
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 14959-31-0 (N-(6-Chloro-3-pyridazinyl)acetamide) Hazard Symbols N/A
Synonyms

Pyridazine,3-acetamido-6-chloro- (7CI);3-Acetamido-6-chloropyridazine;N-(6-Chloro-3-pyridazinyl)acetamide;

Article Data 9

N-(6-Chloro-3-pyridazinyl)acetamide Specification

The N-(6-Chloro-3-pyridazinyl)acetamide with the CAS number 14959-31-0 is also called Acetamide,N-(6-chloro-3-pyridazinyl)-. The systematic name is N-(6-chloropyridazin-3-yl)acetamide. Its molecular formula is C6H6ClN3O. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the N-(6-Chloro-3-pyridazinyl)acetamide are: (1)ACD/LogP: 0.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.44; (4)ACD/LogD (pH 7.4): 0.44; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 10.38; (8)ACD/KOC (pH 7.4): 10.38; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 54.88 Å2; (13)Index of Refraction: 1.604; (14)Molar Refractivity: 41.6 cm3; (15)Molar Volume: 120.9 cm3; (16)Polarizability: 16.49×10-24cm3; (17)Surface Tension: 59 dyne/cm; (18)Enthalpy of Vaporization: 72.27 kJ/mol; (19)Vapour Pressure: 1.04×10-8 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(C)Nc1ccc(Cl)nn1
(2)InChI: InChI=1/C6H6ClN3O/c1-4(11)8-6-3-2-5(7)9-10-6/h2-3H,1H3,(H,8,10,11)
(3)InChIKey: UNQTYWWIVXWOJT-UHFFFAOYAZ

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