Structural formula
| Business number | 01QC |
|---|---|
| Molecular formula | C17H20O2 |
| Molecular weight | 256.34 |
| label |
4,4′-(1-methylethylene)bis(2-methylphenol), 4,4′-Isopropylidene-o-cresol |
Numbering system
CAS number:79-97-0
MDL number:MFCD00002232
EINECS number:201-240-0
RTECS number:GP1750000
BRN number:None
PubChem number:24891789
Physical property data
1. Characteristics: white crystalline powder
2. Density (g/mL,25/4℃): Unsure
3. Relative vapor density (g/mL,AIR=1): Unsure
4. Melting point (ºC):210 ℃～217
5. Boiling point (ºC,Normal pressure): Uncertain
6. Boiling point (ºC,5.2kPa): Unsure
7. Refractive index: Uncertain
8. Flash Point (ºC): Unsure
9. Specific optical rotation (º): Unsure
10. Autoignition point or ignition temperature (ºC): Unsure
11. Vapor pressure (kPa,25ºC): Unsure
12.
Molecular structure data
5. Molecular property data:
1. Molar refractive index: 77.81
2. Molar volume (m3/mol）：232.1
3. isotonic specific volume (90.2K):595.1
4. Surface Tension (dyne/cm):43.2
5. <SPAN style="FONT -SIZE: 9pt; FONT-FAMILY: 宋体; mso-ascii-font-family: Arial; mso-hansi-font-f
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 4.7
2. Number of hydrogen bond donors: 2
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 2
5. Number of tautomers: 5
6. Topological molecule polar surface area 40.5
7. Number of heavy atoms: 19
8. Surface charge: 0
9. Complexity: 272
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 place.
Synthesis method
None yet
Purpose
Organic synthesis and biochemical research.
Quality and Stability
None yet
Storage method
This product should be sealed and stored in a cool place.
Synthesis method
None yet
Purpose
Organic synthesis and biochemical research.
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