2-Aminotrifluorotoluene

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:88-17-5

MDL number:MFCD00007718

EINECS number:201-806-7

RTECS number:XU9210000

BRN number:879494

PubChem number:24845816

Physical property data

1. Properties: colorless or light yellow liquid, irritating

2. Density (g/mL, 25/4℃): 1.282

3. Relative steam Density (g/mL, air=1): Undetermined

4. Melting point (ºC): 34

5. Boiling point (ºC, normal pressure): 68

6. Boiling point (ºC, 1.33kpa): Not determined

7. Refractive index: Not determined

8. Flash point (ºC): 55

9. Specific optical rotation (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: decomposes when exposed to water. Has aniline smell

Toxicological data

None yet

Ecological data

None yet

Molecular structure data

1. Molar refractive index: 35.46

2. Molar volume (cm³/mol): 125.2

3. Isotonic specific volume (90.2K ): 290.3

4. Surface tension (dyne/cm): 28.8

5. Polarizability (10-24cm3): 14.06

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 4

4. Number of rotatable chemical bonds: 0

5. Number of tautomers: none

6. Topological molecule polar surface area 26

7. Number of heavy atoms: 11

8. Surface charge: 0

9. Complexity: 132

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine ���Number of stereocenters of chemical bonds: 0

14. Number of stereocenters of uncertain chemical bonds: 0

15. Number of covalent bond units: 1

Properties and stability

None yet

Storage method

This product should be kept sealed and dry.

Synthesis method

None yet

Purpose

This product is an important intermediate for the synthesis of fluorine-containing herbicides, medicines and dyes.