Pyrazinecarboxamide, 6-chloro- supplier

Name
6-CHLORO-2-PYRAZINECARBOXAMIDE
EINECS
CAS No. 36070-79-8
Article Data9
CAS DataBase
Density 1.478 g/cm³
Solubility
Melting Point 180-182℃
Formula C₅H₄ClN₃O
Boiling Point 311.7 °C at 760 mmHg
Molecular Weight 157.559
Flash Point 142.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Chloro-2-pyrazinecarboxamide;
PSA 68.87000
LogP 0.92920

Pyrazinecarboxamide, 6-chloro- Specification

The Pyrazinecarboxamide, 6-chloro-, with the CAS registry number 36070-79-8, is also known as 6-Chloro-2-pyrazinecarboxamide. This chemical's molecular formula is C₅H₄ClN₃O and molecular weight is 157.56. What's more, its systematic name is 6-chloropyrazine-2-carboxamide.

Physical properties of Pyrazinecarboxamide, 6-chloro- are: (1)ACD/LogP: 0.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.73; (4)ACD/LogD (pH 7.4): 0.73; (5)ACD/BCF (pH 5.5): 2.1; (6)ACD/BCF (pH 7.4): 2.1; (7)ACD/KOC (pH 5.5): 59.15; (8)ACD/KOC (pH 7.4): 59.15; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 46.09 Å²; (13)Index of Refraction: 1.596; (14)Molar Refractivity: 36.26 cm³; (15)Molar Volume: 106.5 cm³; (16)Polarizability: 14.37×10^-24cm³; (17)Surface Tension: 67.9 dyne/cm; (18)Density: 1.478 g/cm³; (19)Flash Point: 142.3 °C; (20)Enthalpy of Vaporization: 55.26 kJ/mol; (21)Boiling Point: 311.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000556 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1nc(Cl)cnc1)N
(2)Std. InChI: InChI=1S/C5H4ClN3O/c6-4-2-8-1-3(9-4)5(7)10/h1-2H,(H2,7,10)
(3)Std. InChIKey: JEERXOCCQAMKAF-UHFFFAOYSA-N

Product Name

6-CHLORO-2-PYRAZINECARBOXAMIDE

Pyrazinecarboxamide, 6-chloro- Specification

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