3,4-Dimethoxybenzoylmethylamine (3,4-Dimethoxybenzyl)methylamine

Structural formula

Business number	01CU
Molecular formula	C10H15NO2
Molecular weight	181.23
label	N-methyl-3,4-dimethoxybenzylamine, 3,4-Dimethoxy-N-methylbenzylamine, (H3CO)2C6H3CH2NHCH3

• 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:63-64-9

MDL number:MFCD00837593

EINECS number:None

RTECS number:None

BRN number:None

PubChem number:24882383

Physical property data

1. Character: Uncertain

2. Density (g/mL,25/4℃):0.951

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, 0.5mmHg):103-106

7. Refractive index:1.5410

8. Flash Point (ºF): >230

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,60ºCExplosion limit (%,V/V): Unsure

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

19. Solubility:Not sure

Toxicological data

None yet

Ecological data

None yet

Molecular structure data

1. Molar refractive index: 52.75

2. Molar volume (m³/mol）：179.0

3. isotonic specific volume (90.2K):425.1

4. Surface Tension (dyne/cm):31.7

5. Polarizability（10^-24cm³):20.91

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: 3

4. Number of rotatable chemical bonds: 4

5. Number of tautomers: none

6. Topological molecule polar surface area 30.5

7. Number of heavy atoms: 13

8. Surface charge: 0

9. Complexity: 141

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 sealed and stored in a cool, dry place.

Synthesis method

None yet

Purpose

None yet

nbsp; Isotonic specific volume (90.2K):425.1

4. Surface Tension (dyne/cm):31.7

5. Polarizability（10^-24cm³):20.91

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: 3

4. Number of rotatable chemical bonds: 4

5. Number of tautomers: none

6. Topological molecule polar surface area 30.5

7. Number of heavy atoms: 13

8. Surface charge: 0

9. Complexity: 141

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 sealed and stored in a cool, dry place.

Synthesis method

None yet

Purpose

None yet