structural formula
| business number | 033d |
|---|---|
| molecular formula | c5h14n2 |
| molecular weight | 102.18 |
| label |
n-propylethylenediamine, n-propylethylenediamine, 2-propylaminoethylamine, n-propyl-1,2-ethanediamine, n-propylethane-1,2-diamine, linear compound |
numbering system
cas number:111-39-7
mdl number:mfcd00008172
einecs number:203-864-9
rtecs number:none
brn number:1697232
pubchem number:24858652
physical property data
none
toxicological data
none
ecological data
none
molecular structure data
5. molecular property data:
1. molar refractive index: 32.34
2. molar volume (m3/mol）：123.5
3. isotonic specific volume (90.2k):288.0
4. surface tension (dyne/cm):29.5
5. polarizability（10-24cm3):12.82
compute chemical data
1. reference value for calculation of hydrophobic parameters (xlogp): -0.3
2. number of hydrogen bond donors: 2
3. number of hydrogen bond acceptors: 2
p>
4. number of rotatable chemical bonds: 4
5. number of tautomers: none
6. topological molecule polar surface area 38
7. number of heavy atoms: 7
8. surface charge: 0
9. complexity: 29.3
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
