4-Dodecylaniline 4-Dodecylaniline
Structural formula
| Business number | 02Q1 |
|---|---|
| Molecular formula | C18H31N |
| Molecular weight | 261.45 |
| label |
4-Dodecylaniline, p-Dodecylaniline, 4-Dodecylaniline, P-Dodecylaniline, 4-Dodecyl-benzenamin, 4-Dodecyl-Benzenamine, 4-n-Dodecylamine, Benzenamine, 4-dodecyl-, Benzenamine,4-dodecyl-, 4-Dodecylibenzenamine |
Numbering system
CAS number:104-42-7
MDL number:MFCD00007919
EINECS number:203-201-3
RTECS number:None
BRN number:2646305
PubChem number:24853981
Physical property data
1. Characteristics: Undetermined
2. Density (g/mL, 20℃): Undetermined
3. Relative vapor density (g/mL, air=1 ): Undetermined
4. Melting point (ºC): 35-39
5. Boiling point (ºC, normal pressure): Undetermined
6. Boiling point (ºC, 15mmHg): 220-221
7. Refractive index: not determined
8. Flash point (ºC): not determined
9. Ratio Optical rotation (º): Undetermined
10. Autoignition point or ignition temperature (ºC): Undetermined
11. Vapor pressure (mmHg,ºC): Undetermined
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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. Log value of oil-water (octanol/water) partition coefficient: Undetermined
17. Explosion upper limit (%, V/V): Undetermined
18. Explosion lower limit (%, V/V): Undetermined
19. Solubility: Undetermined OK
Toxicological data
None yet
Ecological data
None yet
Molecular structure data
1. Molar refractive index: 86.36
2. Molar volume (cm3/mol): 289.5
3. Isotonic specific volume (90.2K ): 707.5
4. Surface tension (dyne/cm): 35.6
5. Dielectric constant:
6. Dipole moment (10-24cm3):
7. Polarizability: 34.23
Compute chemical data
1. Hydrophobic parameter calculation reference value (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 1
4. Number of rotatable chemical bonds: 11
5. Number of tautomers: None
6. Topological molecule polar surface area 26
7. Number of heavy atoms: 19
8. Surface charge: 0
9. Complexity: 182
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 0
12. Uncertain number of atomic stereocenters: 0
13. Determined number of chemical bond stereocenters: 0
14. Uncertain chemical bond stereocenters Quantity: 0
15. Quantity of covalent bond units: 1
Properties and stability
None yet
Storage method
None yet
Synthesis method
None yet
Purpose
Used in the manufacture of Kaplan Yellow 3GS, Kaplan Pink BS, Kaplan Blue BS and other dyes