1,4-Diethoxybenzene 1,4-Diethoxybenzene

Structural formula

• Numbering system
• Physical property data
• Toxicological data
• Ecological data
• Molecular structure data
• Computing chemical data
• More
  • Properties and Stability
  • Storage method
  • Synthesis method
  • Purpose

Numbering system

CAS number:122-95-2

MDL number:MFCD00015146

EINECS number:204-585-5

RTECS number:None

BRN number:None

PubChem number:24878716

Physical property data

1. Melting point (℃): 72

2. Boiling point (ºC): 246

3. Solubility: insoluble in water

Toxicological data

None yet

Ecological data

None yet

Molecular structure data

5. Molecular property data:

1. Molar refractive index: 48.87

2. Molar volume (cm³/mol): 170.4

3. Isotonic specific volume (90.2K): 400.1

4. Surface tension (dyne/cm): 30.3

5. Polarizability (10^-24cm³): 19.37

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 2

4. Number of rotatable chemical bonds: 4

5. Number of tautomers: none

6. Topological molecule polar surface area 18.5

7. Number of heavy atoms: 12

8. Surface charge: 0

9. Complexity: 92.4

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

None yet

Storage method

None yet

Synthesis method

None yet

Purpose

1. Application

Organic intermediates