structural formula
| business number | 03qw |
|---|---|
| molecular formula | c15h25cln2o2 |
| molecular weight | 300.83 |
| label |
4-(butylamino)-benzoic acid-2-(dimethylamino)ethyl ester hydrochloride, pantocaine, 4-(butylamino)benzoic acid 2-(dimethylamino)ethyl ester, local anesthetic |
numbering system
cas number:136-47-0
mdl number:mfcd00038912
einecs number:205-248-5
rtecs number:dg4900000
brn number:none
pubchem number:24277740
physical property data
none
toxicological data
none
ecological data
none
molecular structure data
none
compute chemical data
1. reference value for hydrophobic parameter calculation (xlogp): none
2. number of hydrogen bond donors: 2
3. number of hydrogen bond acceptors: 4
4. number of rotatable chemical bonds: 9
5. number of tautomers: 3
6. topological molecule polar surface area 41.6
7. number of heavy atoms: 20
8. surface charge: 0
9. complexity: 249
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: 2
properties and stability
none
storage method
none
synthesis method
none
purpose
none
