2,5-Diethoxybenzo-1,4-quinone supplier

Name
2,5-diethoxycyclohexa-2,5-diene-1,4-dione
EINECS
CAS No. 20765-04-2
Article Data9
CAS DataBase
Density 1.16 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₂O₄
Boiling Point 333.7 °C at 760 mmHg
Molecular Weight 196.203
Flash Point 148.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,5-diethoxycyclohexa-2,5-diene-1,4-dione;2,5-diethoxy-1,4-benzoquinone;
PSA 52.60000
LogP 0.97900

2,5-Diethoxybenzo-1,4-quinone Specification

The 2,5-Diethoxybenzo-1,4-quinone, with CAS registry number 20765-04-2, has the systematic name of 2,5-diethoxycyclohexa-2,5-diene-1,4-dione. And its IUPAC name is the same one. Besides this, it is also called 2,5-cyclohexadiene-1,4-dione, 2,5-diethoxy-. And the chemical formula of this chemical is C₁₀H₁₂O₄.

Physical properties of 2,5-Diethoxybenzo-1,4-quinone: (1)ACD/LogP: 1.35; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 52.6 Å²; (7)Index of Refraction: 1.498; (8)Molar Refractivity: 49.37 cm³; (9)Molar Volume: 168.4 cm³; (10)Polarizability: 19.57×10^-24cm³; (11)Surface Tension: 38.5 dyne/cm; (12)Enthalpy of Vaporization: 57.65 kJ/mol; (13)Vapour Pressure: 0.000135 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1/C=C(/OCC)C(=O)\C=C1\OCC
(2)InChI: InChI=1/C10H12O4/c1-3-13-9-5-8(12)10(14-4-2)6-7(9)11/h5-6H,3-4H2,1-2H3
(3)InChIKey: XMTVIMLHAWZAAB-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C10H12O4/c1-3-13-9-5-8(12)10(14-4-2)6-7(9)11/h5-6H,3-4H2,1-2H3
(5)Std. InChIKey: XMTVIMLHAWZAAB-UHFFFAOYSA-N

Product Name

2,5-diethoxycyclohexa-2,5-diene-1,4-dione

2,5-Diethoxybenzo-1,4-quinone Specification

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