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Name |
Pyridine,2-(4-methoxyphenoxy)-3-nitro- |
EINECS | N/A |
CAS No. | 76893-48-6 | Density | 1.302 g/cm3 |
PSA | 77.17000 | LogP | 3.31390 |
Solubility | N/A | Melting Point |
95 °C |
Formula | C12H10N2O4 | Boiling Point | 368.8 °C at 760 mmHg |
Molecular Weight | 246.222 | Flash Point | 176.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-(4-Methoxyphenoxy)-3-nitropyridine; |
Article Data | 3 |
The Pyridine,2-(4-methoxyphenoxy)-3-nitro- is an organic compound with the formula C12H10N2O4. With the CAS registry number 76893-48-6, the systematic name of this chemical is 2-(4-methoxyphenoxy)-3-nitropyridine.
Physical properties about Pyridine,2-(4-methoxyphenoxy)-3-nitro- are: (1)ACD/LogP: 1.32; (2)ACD/LogD (pH 5.5): 1.31; (3)ACD/LogD (pH 7.4): 1.31; (4)ACD/BCF (pH 5.5): 5.88; (5)ACD/BCF (pH 7.4): 5.88; (6)ACD/KOC (pH 5.5): 123.63; (7)ACD/KOC (pH 7.4): 123.63; (8)#H bond acceptors: 6; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 77.17 Å2; (11)Index of Refraction: 1.592; (12)Molar Refractivity: 64.01 cm3; (13)Molar Volume: 189 cm3; (14)Polarizability: 25.37×10-24cm3; (15)Surface Tension: 50.7 dyne/cm; (16)Density: 1.302 g/cm3; (17)Flash Point: 176.9 °C; (18)Enthalpy of Vaporization: 59.13 kJ/mol; (19)Boiling Point: 368.8 °C at 760 mmHg; (20)Vapour Pressure: 2.63E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c2cccnc2Oc1ccc(OC)cc1
(2)InChI: InChI=1/C12H10N2O4/c1-17-9-4-6-10(7-5-9)18-12-11(14(15)16)3-2-8-13-12/h2-8H,1H3
(3)InChIKey: RRWDAVSBLSUVEI-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C12H10N2O4/c1-17-9-4-6-10(7-5-9)18-12-11(14(15)16)3-2-8-13-12/h2-8H,1H3
(5)Std. InChIKey: RRWDAVSBLSUVEI-UHFFFAOYSA-N