4,6-Dichloronicotinamide supplier

Name
4,6-DICHLORO-NICOTINAMIDE
EINECS
CAS No. 70593-57-6
Article Data8
CAS DataBase
Density 1.524g/cm³
Solubility
Melting Point 153-155°C
Formula C₆H₄Cl₂N₂O
Boiling Point 302.9 °C at 760 mmHg
Molecular Weight 191.017
Flash Point 137 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Nicotinamide,4,6-dichloro- (7CI);4,6-Dichloro-3-pyridinecarboxamide;4,6-Dichloronicotinamide;
PSA 55.98000
LogP 2.18760

4,6-Dichloronicotinamide Specification

The 4,6-Dichloronicotinamide, with CAS registry number 70593-57-6, belongs to the following product category: Pyridines. It has the systematic name of 4,6-dichloropyridine-3-carboxamide. Besides this, it is also called 4,6-Dichloronicotinamide. And the chemical formula of this chemical is C₆H₄Cl₂N₂O.

Physical properties of 4,6-Dichloronicotinamide: (1)ACD/LogP: 0.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.79; (4)ACD/LogD (pH 7.4): 0.79; (5)ACD/BCF (pH 5.5): 2.34; (6)ACD/BCF (pH 7.4): 2.34; (7)ACD/KOC (pH 5.5): 64.06; (8)ACD/KOC (pH 7.4): 64.06; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 33.2 Å²; (13)Index of Refraction: 1.603; (14)Molar Refractivity: 43.06 cm³; (15)Molar Volume: 125.2 cm³; (16)Polarizability: 17.07×10^-24cm³; (17)Surface Tension: 59.2 dyne/cm; (18)Density: 1.524 g/cm³; (19)Flash Point: 137 °C; (20)Enthalpy of Vaporization: 54.31 kJ/mol; (21)Boiling Point: 302.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000965 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1c(C(=O)N)cnc(Cl)c1
(2)InChI: InChI=1/C6H4Cl2N2O/c7-4-1-5(8)10-2-3(4)6(9)11/h1-2H,(H2,9,11)
(3)InChIKey: IQVYHPUXNYVYFW-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C6H4Cl2N2O/c7-4-1-5(8)10-2-3(4)6(9)11/h1-2H,(H2,9,11)
(5)Std. InChIKey: IQVYHPUXNYVYFW-UHFFFAOYSA-N

Product Name

4,6-DICHLORO-NICOTINAMIDE

4,6-Dichloronicotinamide Specification

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