1,1′-Iminodianthraquinone 1,1′-Iminodianthraquinone

Structural formula

Business number	01SS
Molecular formula	C28H15NO4
Molecular weight	429.42
label	Di(1-anthraquinoyl)amine

• 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:82-22-4

MDL number:MFCD00019132

EINECS number:201-405-7

RTECS number:CB7780000

BRN number:2607016

PubChem number:24860233

Physical property data

1. Character:Dark red needle-shaped crystalline powder

2. Density (g/mL,25/4℃): Unsure

3. Relative vapor density ( g/mL,Air =1): No OK

4. Melting point (ºC):≥300℃

5. Boiling point (ºC,Normal pressure): Unsure

6. Boiling point (ºC,5.2kPa): Unsure

7. Refractive index: Uncertain

8. Flashpoint (ºC): Unsure

9. Specific optical rotation (º): Unsure

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

11. Vapor pressure (kPa,25ºC): Unsure

12. Saturated vapor pressure (kPa,60ºCExplosion limit (%,V/V): Unsure

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

19. Solubility:Soluble in concentrated sulfuric acid, it becomes a scarlet solution, and turns into olive green during storage. It is slightly soluble in aniline, nitrobenzene, chlorobenzene, and quinine. Phenoline is almost insoluble in organic solvents with low boiling points.

Toxicological data

2 , Neurotoxicity:

Rabbit skin test: 500 mg/24HREACTION; Rabbit eye test: 500 mg/24HREACTION;

Ecological data

None yet

Molecular structure data

1. Molar refractive index: 120.45

2. Molar volume (m³/mol）：294.7

3. isotonic specific volume (90.2K):864.6

4. Surface Tension (dyne/cm):74.0

5. Polarizability（10^-24cm³):47.75

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 5.9

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 5

4. Number of rotatable chemical bonds: 2

5. Number of tautomers: 5

6. Topological molecule polar surface area 80.3

7. Number of heavy atoms: 33

8. Surface charge: 0

9. Complexity: 783

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

Seal and store in a dark place.

Synthesis method

None yet

Purpose

For the determination of boron, germanium, selenium, tellurium and silicon.

ist 36.0pt” align=left>2. Molar volume (m³/mol)：294.7

3. isotonic specific volume (90.2K):864.6

4. Surface Tension (dyne/cm):74.0

5. Polarizability（10^-24cm³):47.75

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 5.9

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 5

4. Number of rotatable chemical bonds: 2

5. Number of tautomers: 5

6. Topological molecule polar surface area 80.3

7. Number of heavy atoms: 33

8. Surface charge: 0

9. Complexity: 783

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

Seal and store in a dark place.

Synthesis method

None yet

Purpose

For the determination of boron, germanium, selenium, tellurium and silicon.

w-orphan; mso-margin-top-alt: auto; mso-margin-bottom-alt: auto” align=left>For the determination of boron, germanium, selenium, tellurium and silicon.