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Cas Database |
| Name |
2(1H)-Pyridinone,1-methyl-5-nitro- |
EINECS | N/A |
| CAS No. | 32896-90-5 | Density | 1.37 g/cm3 |
| PSA | 67.82000 | LogP | 0.81670 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C6H6N2O3 | Boiling Point | 287.5 °C at 760 mmHg |
| Molecular Weight | 154.125 | Flash Point | 127.7 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2(1H)-Pyridone,1-methyl-5-nitro- (7CI,8CI);1-Methyl-5-nitro-1H-pyridin-2-one;1-Methyl-5-nitro-2-pyridone;1-Methyl-5-nitropyridin-2(1H)-one;5-Nitro-1-methyl-2(1H)-pyridone;NSC 165483; |
Article Data | 3 |
2(1H)-Pyridinone,1-methyl-5-nitro- Specification
This chemical is called 2(1H)-Pyridinone,1-methyl-5-nitro-, and its systematic name is 1-methyl-5-nitropyridin-2(1H)-one. With the molecular formula of C6H6N2O3, its molecular weight is 154.1234. The CAS registry number of this chemical is 32896-90-5.
Other characteristics of the 2(1H)-Pyridinone,1-methyl-5-nitro- can be summarised as followings: (1)ACD/LogP: -0.72; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 66.13 Å2; (7)Index of Refraction: 1.582; (8)Molar Refractivity: 37.4 cm3; (9)Molar Volume: 112 cm3; (10)Polarizability: 14.82×10-24cm3; (11)Surface Tension: 53.1 dyne/cm; (12)Density: 1.37 g/cm3; (13)Flash Point: 127.7 °C; (14)Enthalpy of Vaporization: 52.67 kJ/mol; (15)Boiling Point: 287.5 °C at 760 mmHg; (16)Vapour Pressure: 0.00248 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C1/C=C\C(\[N+]([O-])=O)=C/N1C
2.InChI: InChI=1/C6H6N2O3/c1-7-4-5(8(10)11)2-3-6(7)9/h2-4H,1H3
3.InChIKey: FZYSOPYUSSFGAO-UHFFFAOYAT
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