dibenzyl sulfide

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:538-74-9

MDL number:MFCD00004784

EINECS number:208-703-6

RTECS number:DC0512500

BRN number:1911157

PubChem ID:None

Physical property data

1. Characteristics: colorless flake crystal

2. Density (g/mL,25/4℃):1.0712

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

4. Melting point (ºC):49

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

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

7. Refractive Index: Undetermined

8. Flash Point (ºＣ）：110

9. Specific optical rotation (º): Undetermined

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

11. Vapor pressure (kPa,25ºC<SPAN style="FONT-FAMILY: 宋体; COLOR: black; FONT-SIZE: 9pt; mso-ascii-fonNone

Molecular structure data

1. Molar refractive index: 68.28

2. Molar volume (m³/mol):196.9

3. isotonic specific volume (90.2K):506.6

4. Surface Tension (dyne/cm):43.8

5. Polarizability（10^-24cm³):27.07

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 3.9

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 1

4. Number of rotatable chemical bonds: 4

5. Number of tautomers: none

6. Topological molecule polar surface area 25.3

7. Number of heavy atoms: 15

8. Surface charge: 0

9. Complexity: 137

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

As required It will not decompose or react when stored, keep away from oxides.

Storage method

Save sealed , place in a ventilated, dry place.

Synthesis method

None yet

Purpose

Used in organic synthesis. Antioxidants

��The number of definite chemical bond stereocenters: 0

14. The uncertain number of chemical bond stereocenters: 0

15. The number of covalent bond units: 1

Properties and stability

As required It will not decompose or react when stored, keep away from oxides.

Storage method

Save sealed , place in a ventilated, dry place.

Synthesis method

None yet

Purpose

Used in organic synthesis. Antioxidants