Ethoxyamidobenzyl ester Ethopabate

Structural formula

Business number	01A5
Molecular formula	C12H15NO4
Molecular weight	237.25
label	Methyl 4-acetamido-2-ethoxybenzoate

• 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:59-06-3

MDL number:MFCD00075809

EINECS number:200-414-3

RTECS number:None

BRN number:2808914

PubChem number:24860750

Physical property data

1. Characteristics: colorless to yellow liquid. It has a fruity, fatty animal aroma and almond aroma. When highly diluted, it has an apple-like aroma, and the concentration is lower than 10mg/kghas a peach scent.

2. Density (g/mL,25/4℃)：0.7977

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

4. Melting point (ºC):– 51

5. Boiling point (ºC,Normal pressure):92.5

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

7. Refractive index:1.390

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

12.

4. Number of rotatable chemical bonds: 5

5. Number of tautomers: 3

6. Topological molecular polar surface area (TPSA):64.6

7. Number of heavy atoms: 17

8. Surface charge: 0

9. Complexity: 280

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. The number of uncertain atomic stereocenters: 0

13. Determine the number of stereocenters of chemical bonds: 0

14. Uncertain number of chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

None yet

Storage method

This product should be sealed in4 Store in a dry place away from light.

Synthesis method

Originated by the reduction of isovaleric acid.
By different Obtained from the oxidation of pentanol

Purpose

GB 2760 96Specified as permitted edible flavors. Mainly used for preparing various fruit flavors.

=”FONT-SIZE: 9pt; FONT-FAMILY: 宋体; mso-bidi-font-family: 宋体”>11, Determine the number of atomic stereocenters: 0

12. The number of uncertain atomic stereocenters: 0

13. Determine the number of stereocenters of chemical bonds: 0

14. Uncertain number of chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

None yet

Storage method

This product should be sealed in4 Store in a dry place away from light.

Synthesis method

Originated by the reduction of isovaleric acid.
By different Obtained from the oxidation of pentanol

Purpose

GB 2760 96Specified as permitted edible flavors. Mainly used for preparing various fruit flavors.