2,6-Difluorobenzaldehyde

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:437-81-0

MDL number:MFCD00010293

EINECS number:000-000-0

RTECS number:None

BRN number:1935273

PubChem number:24856057

Physical property data

一 , physical property data

Traits ：Yellow liquid

Density (g/mL,25/4℃): 1.317

Relative Vapor density (g/mL, air=1)：Not available

Melting point (ºC): 15-17

Boiling point (ºC, normal pressure):82-84

Boiling point (ºC, 5.2kPa): Not available

Refraction Rate: 1.506-1.509

Flash Point (ºC): 73

Optical rotation (º): Not available

Spontaneous combustion Point or ignition temperature (ºC): Not available

Steam Pressure (kPa, 25ºC): Not available

saturated Vapor pressure (kPa, 60ºC): Not available

Burn Heat (KJ/mol):Not available

Critical Temperature (ºC): Not available

Critical Pressure (KPa): Not available

oil and water Log value of the (octanol/water) partition coefficient:Not available

Explosion Upper limit (%, V/V): Not available

Explosion Lower limit (%, V/V): Not available

Dissolve Properties: Not available

Toxicological data

Two , Toxicological data:

Acute Toxicity:Not available .

Ecological data

Three , Ecological data:

1 ,Other harmful effects: This substance may be harmful to the environment, and special treatment should be given to water bodies. Notice.

Molecular structure data

1、 Molar refractive index:32.99

2、 Molar volume（m³/mol)：109.5

3, Isotonic specific volume (90.2K): 266.5

4、 Surface tension（dyne/cm)：35.1

5、 Polarizability(10^-24cm³）：13.07

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 1.6

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 3

4. RotatableNumber of converted chemical bonds: 1

5. Number of tautomers: None

6. Topological molecule polar surface area 17.1

7. Number of heavy atoms: 10

8. Surface charge: 0

9. Complexity: 117

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

Intermediates for pharmaceuticals, pesticides, and liquid crystal materials.

Resource:allhdi.com