o-chlorobenzylamine

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:89-97-4

MDL number:MFCD00008108

EINECS number:201-955-8

RTECS number:None

BRN number:907186

PubChem number:24892521

Physical property data

1. Properties: Undetermined

2. Density (g/mL, 25/4℃): 1.17

3. Relative vapor density (g/mL, air = 1): Undetermined

4. Melting point (ºC):

5. Boiling point (ºC, normal pressure): 103-104

6. Boiling point (ºC) ºC, 5.2kPa): Undetermined

7. Refractive index: 1.562-1.564

8. Flash point (ºC): 88

9. Specific rotation Degree (º): Undetermined

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

11. Vapor pressure (kPa, 25ºC): Undetermined

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

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

14. Critical temperature (ºC) : Undetermined

15. Critical pressure (KPa): Undetermined

16. Log value of oil-water (octanol/water) partition coefficient: Undetermined

17. Explosion upper limit (%, V/V): Undetermined

18. Explosion lower limit (%, V/V): Undetermined

19. Solubility: Undetermined

20.

Toxicological data

None

Ecological data

None

Molecular structure data

1. Molar refractive index: 39.59

2. Molar volume (cm³/mol): 121.3

3. Isotonic specific volume (90.2K ): 308.9

4. Surface tension (dyne/cm): 42.0

5. Polarizability (10-24cm3): 15.69

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 1.4

2. Number of hydrogen bond donors: 1

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 26

7.CriticalNumber of atoms: 9

8. Surface charge: 0

9. Complexity: 85

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 place.

Synthesis method

None

Purpose

Pharmaceutical intermediates.