4-Nitrostyrene 4-Nitrostyrene
Structural formula
| Business number | 02H8 |
|---|---|
| Molecular formula | C8H7NO2 |
| Molecular weight | 149.15 |
| label |
4-nitrostyrene, p-nitrostyrene, 1-Ethenyl-4-nitro-benzen, 1-Ethenyl-4-nitrobenzene, P-Nitro-styren, 4-Nitrostyrene, 1-Nitro-4-vinyl-benzene, 4-Nitrostyrene, GC 97%, 4-Nitrostyrene(stabilized with tbc), 1-(p-Nitrophenyl)ethene |
Numbering system
CAS number:100-13-0
MDL number:None
EINECS number:None
RTECS number:WL5470000
BRN number:None
PubChem ID:None
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): 20
5. Boiling point (ºC, normal pressure): Undetermined
6. Boiling point (ºC) , 10mmHg): 120
7. Refractive index: Undetermined
8. Flash point (ºC): 109
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. Log value of oil-water (octanol/water) partition coefficient: Undetermined
17. Explosion Upper limit (%, V/V): Undetermined
18. Lower explosion limit (%, V/V): Undetermined
19. Solubility: Undetermined
Toxicological data
Mutagenicity: Mutagenic microorganism test: Bacteria – Salmonella typhimurium, 100μg/plate;
Ecological data
None yet
Molecular structure data
1. Molar refractive index: 43.72
2. Molar volume (cm3/mol): 127.2
3. Isotonic specific volume (90.2K ): 327.7
4. Surface tension (dyne/cm): 44.0
5. Dielectric constant:
6. Dipole moment (10-24cm3):
7. Polarizability: 17.33
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 1
5. Number of tautomers: none
6. Topological molecule polar surface area 45.8
7. Number of heavy atoms: 11
8. Surface charge: 0
9. Complexity: 154
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
None yet
Synthesis method
None yet
Purpose
None yet
