Structural formula
| Business number | 05ZB |
|---|---|
| Molecular formula | C16H17N3O |
| Molecular weight | 267.33 |
| label |
Paraacetamidoazobenzene, Azo-acetyl amino-toluene |
Numbering system
CAS number:588-23-8
MDL number:None
EINECS number:None
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
1. Physical property data
1. Melting point (ºC): 187
Toxicological data
None
Ecological data
None
Molecular structure data
Molecular property data: 1、 Molar refractive index:80.64 2, Molar volume (m3/mol):241.9 3, Isotonic specific volume (90.2K ):604.9 4, Surface tension (dyne/ cm):39.0 5、 Polarizability (10-24cm3):31.96 |
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 3
4. Number of rotatable chemical bonds: 3
5. Number of tautomers: 5
6. Topological molecule polar surface area 53.8
7. Number of heavy atoms: 20
8. Surface charge: 0
9. Complexity: 356
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
