m-Tolyldiethanolamine

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:91-99-6

MDL number:None

EINECS number:202-114-8

RTECS number:KM3360000

BRN number:None

PubChem ID:None

Physical property data

1. Characteristics: white crystal.

2. Density (g/mL,25/4℃)： Undetermined

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

4. Melting point (ºC):72 ～73

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

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

7. Refractive Index: Undetermined

8. Flash Point (ºC): Undetermined

9. Specific optical rotation (º): Undetermined

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

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

3. Isotonic specific volume (90.2K) ：459.9

4. Surface Tension (dyne/cm):51.4

5. Polarizability（10^-24cm³):22.88

Compute chemical data

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

2. Number of hydrogen bond donors: 2

3. Number of hydrogen bond acceptors: 3

4. Number of rotatable chemical bonds: 5

5. Number of tautomers: none

6. Topological molecule polar surface area 43.7

7. Number of heavy atoms: 14

8. Surface charge: 0

9. Complexity: 146

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

This product should be kept sealed.

Synthesis method

None yet

Purpose

For organic synthesis.
Used as solvent red117, scattered purple33、40、 43, scattered blue96、295, scattered Black4、10, scattered red5, 12、 16, 17, 128、129Intermediates for dyes.

-US style=”FONT-SIZE: 9pt; FONT-FAMILY: Times New Roman”>33, 40、43, scattered blue96, 295, dispersed black4、10, scattered red5 , 12、 16, 17, 128 , 129Intermediates for dyes.