structural formula
| business number | 03d2 |
|---|---|
| molecular formula | c16h26o |
| molecular weight | 234.38 |
| label |
2,4-di-tert-pentylbenzene, 2,4-dipentylphenol, 2,4-bis(1,1-dimethylpropyl)phenol, 2,4-di-tert-amylphenol, 2,4-bis(1,1-dimethylpropyl)-pheno, 2,4-di-tert-pentyl-pheno, 2,4-di-tert-pentylphenyl, di-tert-amylphenol, phenol, 2,4-bis(1,1-dimethylpropyl)-, phenol, 2,4-di-tert-pentyl-, phenol,2,4-bis(1,1-dimethylpropyl, prodox 156, aromatic compounds |
numbering system
cas number:120-95-6
mdl number:mfcd00041929
einecs number:204-439-0
rtecs number:sl3500000
brn number:none
pubchem number:24863017
physical property data
1. density:0.930
2. refractive index:1.506~1.508
3. flash dot (℃):143
4. melting point (℃):25
toxicological data
none
ecological data
none
molecular structure data
5. molecular property data:
1. molar refractive index: 74.17
2. molar volume（m3/ mol）：254.2
3. isotonic ratio（90.2k）：597.9
4. surface tension（dyne/cm）：30.5
5. dielectric constant:
6. dipole moment（10 -24cm3)：
7. polarizability: 3. isotonic specific volume（90.2k)：597.9
4. surface tension（dyne/cm）：30.5
5. dielectric constant:
6. dipole moment（10 -24cm3)：
7. polarizability: 29.40
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 6
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 1
4. number of rotatable chemical bonds: 4
5. number of tautomers: 3
6. topological molecule polar surface area 20.2
7. number of heavy atoms: 17
8. surface charge: 0
9. complexity: 242
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
storage method
none
synthesis method
none
purpose
none
“>29.40
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): 6
2. number of hydrogen bond donors: 1
3. number of hydrogen bond acceptors: 1
4. number of rotatable chemical bonds: 4
5. number of tautomers: 3
6. topological molecule polar surface area 20.2
7. number of heavy atoms: 17
8. surface charge: 0
9. complexity: 242
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
storage method
none
synthesis method
none
purpose
none
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