Structural formula

Business number	01T8
Molecular formula	C26H33Cl2N3
Molecular weight	458.47
label	Heptamethyl-p-rosaniline chloride, Methyl Green Dichloride, Heptamethyl-p-rosaniline Chloride

• 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:82-94-0

MDL number:None

EINECS number:201-447-6

RTECS number:None

BRN number:None

PubChem ID:None

Physical property data

1. Physical property data

1. Character:Green microcrystalline or bright green powder with metallic luster

2. Density (g/mL,25/4℃)：1.72

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

4. Melting point (ºC): 233

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

6. Boiling point (ºC,5.2kPa): Unsure

7. Refractive index: Uncertain

8. Flash Point (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 ,60ºC): Unsure

13. Heat of combustion (KJ/mol): Unsure

14. Critical temperature (ºC): Unsure

15. Critical pressure (KPa): Unsure

16. Oil and water (octanol/Log value of water) partition coefficient: Uncertain

17. Explosion limit (%,V/V): Unsure

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

19. Solubility:Soluble in water, appears blue-green. Slightly soluble in ethanol, insoluble in amyl alcohol

Toxicological data

None yet

Ecological data

None yet

Molecular structure data

None yet

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: 3

4. Number of rotatable chemical bonds: 4

5. Number of tautomers: none

6. Topological molecule polar surface area 6.2

7. Number of heavy atoms: 31

8. Surface charge: 0

9. Complexity: 625

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: 3

Properties and stability

None yet

Storage method

None yet

Synthesis method

None yet

Purpose

None yet

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