Basic Information | Post buying leads | Suppliers |
Name |
4-(2-Chloroethoxy)-5-methoxy-2-nitrobenzaldehyde |
EINECS | N/A |
CAS No. | 348618-75-7 | Density | 1.375 g/cm3 |
PSA | 81.35000 | LogP | 2.55670 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H10ClNO5 | Boiling Point | 452.098 °C at 760 mmHg |
Molecular Weight | 259.64 | Flash Point | 227.221 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-(2-Chloroethoxy)-5-methoxy-2-nitrobenzaldehyde;Benzaldehyde, 4-(2-chloroethoxy)-5-methoxy-2-nitro- |
The 4-(2-Chloroethoxy)-5-methoxy-2-nitrobenzaldehyde, with the cas registry number 348618-75-7, is a kind of organics. And the molecular formula of the chemical is C10H10ClNO5.
The characteristics of this chemical are as followings: (1)ACD/LogP: 2.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 60; (6)ACD/BCF (pH 7.4): 60; (7)ACD/KOC (pH 5.5): 651; (8)ACD/KOC (pH 7.4): 651; (9)#H bond acceptors: 6; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 81.35 Å2; (13)Index of Refraction: 1.575; (14)Molar Refractivity: 62.39 cm3; (15)Molar Volume: 188.837 cm3; (16)Polarizability: 24.733×10-24cm3; (17)Surface Tension: 48.908 dyne/cm; (18)Density: 1.375 g/cm3; (19)Flash Point: 227.221 °C; (20)Enthalpy of Vaporization: 71.126 kJ/mol; (21)Boiling Point: 452.098 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=N(=O)c1cc(OCCCl)c(cc1C=O)OC
(2)InChI: InChI=1/C10H10ClNO5/c1-16-9-4-7(6-13)8(12(14)15)5-10(9)17-3-2-11/h4-6H,2-3H2,1H3
(3)InChIKey: IXMWLBHKAMOOEB-UHFFFAOYAK