fennel

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:119-52-8

MDL number:MFCD00008411

EINECS number:204-330-8

RTECS number:None

BRN number:486157

PubChem number:24891373

Physical property data

1. Characteristics: crystalline powder

2. Density (g/mL,25℃): Undetermined

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

4. Melting point (ºC): 112

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

6. Boiling point (ºC, KPa): Undetermined

7. Refractive index: Undetermined

8. Flashpoint (ºC): Undetermined

9. Specific rotation (º): Undetermined

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

11. Vapor pressure (mmHg,ºC): Undetermined

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

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

14. Critical temperature (ºC): Undetermined

15. Critical pressure (KPa): Undetermined

16. Oil and water (octanol/Log value of the partition coefficient for water: undetermined

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

3、 Isotonic specific volume (90.2K)：593.3

4、 Surface Tension (dyne/cm):45.9

5、 Polarizability (10^-24cm³):29.99

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: 5

5. Number of tautomers: 2

6. Topological molecule polar surface area 55.8

7. Number of heavy atoms: 20

8. Surface charge: 0

9. Complexity: 302

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 1

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

Avoid withStrong oxidizing agentContact.

Storage method

Stored in a cool, ventilated warehouse. Keep away from fire. should be kept away from oxidizer, do not store together. Equipped with the appropriate variety and quantity of fire equipment.

Storage areas should be equipped with suitable materials to contain spills.

Synthesis method

None yet

Purpose

None yet

-FAMILY: 宋体; mso-bidi-font-family: Tahoma”>Avoid withStrong oxidantContact.

Storage method

Stored in a cool, ventilated warehouse. Keep away from fire. should be kept away from oxidizer, do not store together. Equipped with the appropriate variety and quantity of fire equipment.

Storage areas should be equipped with suitable materials to contain spills.

Synthesis method

None yet

Purpose

None yet