phenoxyethylpenicillin potassium
Structural formula
| Business number | 03NT |
|---|---|
| Molecular formula | C17H19KN2O5S |
| Molecular weight | 402.51 |
| label |
phenoxyethylpenicillin, phenethylpenicillin, phenecillin potassium, Penicillin 152, Penicillin B, ampicillin potassium, aromatic compounds |
Numbering system
CAS number:132-93-4
MDL number:None
EINECS number:205-084-4
RTECS number:None
BRN number:None
PubChem ID:None
Physical property data
None yet
Toxicological data
Acute toxicity data:
Rat abdominal cavityLD50: 1750mg/kg
Mice orally LD50 ：>2mg/kg
Mouse abdominal cavityLD50: 1896mg/kg
Mouse veinLD50:312mg/kg
Dog VeinLD50:>103mg/kg
Guinea pig veinLD50:324mg/kg
Ecological data
None yet
Molecular structure data
None yet
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP):
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 5
4. Number of rotatable chemical bonds: 5
5. Number of tautomers: 2
6. Topological molecular polar surface area (TPSA):98.8
7. Number of heavy atoms: 26
8. Surface charge: 0
9. Complexity: 582
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 3
12. The number of uncertain atomic stereocenters: 1
13. Determine the number of stereocenters of chemical bonds: 0
14. Uncertain number of chemical bond stereocenters: 0
15. Number of covalent bond units: 2
Properties and stability
None yet
Storage method
None yet
Synthesis method
None yet
Purpose
None yet
; FONT-FAMILY: Arial; mso-bidi-font-family: Arial”>Surface charge: 0
9. Complexity: 582
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 3
12. The number of uncertain atomic stereocenters: 1
13. Determine the number of stereocenters of chemical bonds: 0
14. Uncertain number of chemical bond stereocenters: 0
15. Number of covalent bond units: 2
Properties and stability
None yet
Storage method
None yet
Synthesis method
None yet
Purpose
None yet
