2,6-Dichlorobenzaldehyde 2,6-Dichlorobenzaldehyde

Structural formula

Business number	01TR
Molecular formula	C7H4Cl2O
Molecular weight	175
label	2,6-Dichlorobenzaldehyde, 2,6-Dichlorobenzaldehyde

• 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:83-38-5

MDL number:MFCD00003307

EINECS number:201-472-2

RTECS number:None

BRN number:386477

PubChem number:24893954

Physical property data

1. Properties: Industrial grade is white or slightly yellow crystalline powder.

2. Density (g/mL,25/4℃): Unsure

3. Relative vapor density (g/mL,AIR=1): Unsure

4. Melting point (ºC):68 -71°C

5. Boiling point (ºC,Normal pressure):165°C

6. Boiling point (ºC,5.2kPa): Unsure

7. Refractive index: Uncertain

8. Flashpoint (ºC): greater than 300
9. Specific optical activity Degree (º): Not sure

10. Autoignition point or ignition temperature (ºC): Unsure

11. Vapor pressure (kPa,25ºC): Unsure

12. Saturated vapor pressure (kPa,60ºC): Unsure

13. 18. Lower explosion limit (%,V/V): Unsure

19. Solubility: Soluble in hot ethanol and hot ether, insoluble in water.

Toxicological data

None

Ecological data

None

Molecular structure data

1. Molar refractive index: 42.79

2. Molar volume (m³/mol）：125.0

3. isotonic specific volume (90.2K):324.0

4. Surface Tension (dyne/cm):45.1

5. Polarizability（10^-24cm³):16.96

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 2.6

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 1

4. Number of rotatable 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

Storage method

This product should be sealed and stored in a cool, dark place.

Synthesis method

None

Purpose

Intermediates for the synthesis of dyes, pesticides and pharmaceuticals. Mainly used to produce acid medium bleached orchidB. It can also be used in the pharmaceutical industry to prepare diclofenac penicillin sodium.

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5. Polarizability（10^-24cm³):16.96

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 2.6

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 1

4. Number of rotatable 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

Storage method

This product should be sealed and stored in a cool, dark place.

Synthesis method

None

Purpose

Intermediates for the synthesis of dyes, pesticides and pharmaceuticals. Mainly used to produce acid medium bleached orchidB. It can also be used in the pharmaceutical industry to prepare diclofenac penicillin sodium.