Chloroisoindolium ammonium diiodide

2024-04-23by admin

Structural formula of chloroisoindolyl ammonium diiodide

Structural formula

Business number 01FL
Molecular formula C34H20N2Cl4I2
Molecular weight 611.95
label

Chloroisoindolyl ammonium chloride,

Indolinium tetrachloride,

Soundalonium chloride

Numbering system

CAS number:69-27-2

MDL number:None

EINECS number:None

RTECS number:None

BRN number:None

PubChem ID:None

Physical property data

1. Characteristics: white solid


2. Density (g/mL,25/4): Unsure


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


4. Melting point (ºC): Unsure


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


6. Boiling point (ºC, 5.2kPa): Unsure


7. Refractive index:Not sure


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,60��C): 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 upper limit (%,V/V): Unsure


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


19. Solubility:H2O: ~3.75 mg/mL

Toxicological data

Acute toxicity: Rat oral LD50: 300 mg/kg; Rat intravenous LD50 28 mg/kg


Mouse oral LD50: 380 mg/kg; Mouse abdominal cavityLD5062 mg/kg;
 Mouse subcutaneous injection LD50: 240 mg/kg; mouse intravenous LD50 SPAN>:28 mg/kg;

Ecological data

None

Molecular structure data

None

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: 3

5. Number of tautomers: none

6. Topological molecule polar surface area 0

7. Number of heavy atoms: 22

8. Surface charge: 0

9. Complexity: 336

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

Storage method

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

Synthesis method

None

Purpose

For biochemical research and organic synthesis.

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