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Name |
2-Pyrazinecarboxamide,5-(hydroxymethyl)- |
EINECS | N/A |
CAS No. | 412277-94-2 | Density | 1.413 g/cm3 |
PSA | 89.10000 | LogP | -0.23190 |
Solubility | N/A | Melting Point |
N/A |
Formula | C6H7N3O2 | Boiling Point | 404.953 °C at 760 mmHg |
Molecular Weight | 153.14 | Flash Point | 198.709 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Pyrazinecarboxamide,5-(hydroxymethyl)- (9CI);5-(hydroxymethyl)pyrazine-2-carboxamide;5-(Hydroxymethyl)pyrazine-2-carboxamide;2-Pyrazinecarboxamide, 5-(hydroxymethyl)-; |
Article Data | 1 |
The 2-Pyrazinecarboxamide,5-(hydroxymethyl)-, with the CAS registry number 412277-94-2, has the systematic name of 5-(hydroxymethyl)pyrazine-2-carboxamide. It belongs to the product categories of Aldehyde and Piperidine. And the molecular formula of this chemical is C6H7N3O2.
The physical properties of 2-Pyrazinecarboxamide,5-(hydroxymethyl)- are as following: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 7.83; (5)ACD/KOC (pH 7.4): 7.83; (6)#H bond acceptors: 5; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 89.1 Å2; (10)Index of Refraction: 1.615; (11)Molar Refractivity: 37.817 cm3; (12)Molar Volume: 108.398 cm3; (13)Polarizability: 14.992×10-24cm3; (14)Surface Tension: 79.365 dyne/cm; (15)Density: 1.413 g/cm3; (16)Flash Point: 198.709 °C; (17)Enthalpy of Vaporization: 69.224 kJ/mol; (18)Boiling Point: 404.953 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1c(ncc(n1)C(=O)N)CO
(2)InChI: InChI=1/C6H7N3O2/c7-6(11)5-2-8-4(3-10)1-9-5/h1-2,10H,3H2,(H2,7,11)
(3)InChIKey: MHGKQVAVEDQFPN-UHFFFAOYAG