4-Nitrophenyl-2-methoxyethyl ether supplier

Name
4-NITROPHENYL-2-METHOXYETHYL ETHER
EINECS
CAS No. 22483-40-5
Article Data9
CAS DataBase
Density 1.283 g/cm³
Solubility
Melting Point
Formula C₁₈H₂₀N₂O₇
Boiling Point 503.8 °C at 760 mmHg
Molecular Weight 197.191
Flash Point 196.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Ethane,1-methoxy-2-(p-nitrophenoxy)- (8CI);1-(2-Methoxyethoxy)-4-nitrobenzene;1-Methoxy-2-(p-nitrophenoxy)ethane;
PSA 64.28000
LogP 2.14320

4-Nitrophenyl-2-methoxyethyl ether Specification

The 4-Nitrophenyl-2-methoxyethyl ether, with the CAS registry number 22483-40-5, has the systematic name of benzene, 1,1'-[oxybis(2-methoxyethylidene)]bis[4-nitro-. And the molecular formula of the chemical is C₁₈H₂₀N₂O₇.

The characteristics of 4-Nitrophenyl-2-methoxyethyl ether are as followings: (1)ACD/LogP: 2.95; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.95; (4)ACD/LogD (pH 7.4): 2.95; (5)ACD/BCF (pH 5.5): 103.18; (6)ACD/BCF (pH 7.4): 103.18; (7)ACD/KOC (pH 5.5): 961.47; (8)ACD/KOC (pH 7.4): 961.47; (9)#H bond acceptors: 9; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 119.33 Å²; (13)Index of Refraction: 1.576; (14)Molar Refractivity: 97.15 cm³; (15)Molar Volume: 293.2 cm³; (16)Polarizability: 38.51×10^-24cm³; (17)Surface Tension: 50.6 dyne/cm; (18)Density: 1.283 g/cm³; (19)Flash Point: 196.2 °C; (20)Enthalpy of Vaporization: 74.39 kJ/mol; (21)Boiling Point: 503.8 °C at 760 mmHg; (22)Vapour Pressure: 8.8E-10 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: COCC(c1ccc(cc1)[N+](=O)[O-])OC(COC)c2ccc(cc2)[N+](=O)[O-]
(2)InChI: InChI=1/C18H20N2O7/c1-25-11-17(13-3-7-15(8-4-13)19(21)22)27-18(12-26-2)14-5-9-16(10-6-14)20(23)24/h3-10,17-18H,11-12H2,1-2H3
(3)InChIKey: HNGXPRKIUMUGPB-UHFFFAOYAO

Product Name

4-NITROPHENYL-2-METHOXYETHYL ETHER

4-Nitrophenyl-2-methoxyethyl ether Specification

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