Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3-Methoxy-4-nitrobenzaldehyde |
EINECS | N/A |
CAS No. | 80410-57-7 | Density | 1.322 g/cm3 |
PSA | 72.12000 | LogP | 1.93910 |
Solubility | N/A | Melting Point |
104 °C |
Formula | C8H7NO4 | Boiling Point | 334.8 °C at 760 mmHg |
Molecular Weight | 181.148 | Flash Point | 171 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3-Methoxy-4-nitrobenzaldehyde; |
Article Data | 28 |
The CAS register number of 3-Methoxy-4-nitrobenzaldehyde is 80410-57-7. It also can be called as Benzaldehyde,3-methoxy-4-nitro- and the systematic name about this chemical is 4-methoxy-3-nitrobenzaldehyde. The molecular formula about this chemical is C8H7NO4 and the molecular weight is 181.14548.
Physical properties about 3-Methoxy-4-nitrobenzaldehyde are: (1)ACD/LogP: 1.68; (2)#H bond acceptors: 5; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 72.12Å2; (5)Index of Refraction: 1.59; (6)Molar Refractivity: 46.22 cm3; (7)Molar Volume: 136.9 cm3; (8)Polarizability: 18.32x10-24cm3; (9)Surface Tension: 50.1 dyne/cm; (10)Enthalpy of Vaporization: 57.78 kJ/mol; (11)Boiling Point: 334.8 °C at 760 mmHg; (12)Vapour Pressure: 0.000125 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1cc(ccc1OC)C=
(2)InChI: InChI=1/C8H7NO4/c1-13-8-3-2-6(5-10)4-7(8)9(11)12/h2-5H,1H3
(3)InChIKey: YTCRQCGRYCKYNO-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C8H7NO4/c1-13-8-3-2-6(5-10)4-7(8)9(11)12/h2-5H,1H3
(5)Std. InChIKey: YTCRQCGRYCKYNO-UHFFFAOYSA-N