Combipenix

Base Information

• Chemical Name: Combipenix
• CAS No.: 51004-51-4
• Deprecated CAS: 52232-32-3
• Molecular Formula: C35H36Cl2N6O9S2
• Molecular Weight: 819.73114
• DSSTox Substance ID: DTXSID30199012
• Mol file: 51004-51-4.mol

Synonyms:ampicillin-dicloxacillin mixture;Combipenix;Totocillin

Chemical Property of Combipenix

Chemical Property:

• Vapor Pressure: 3.98E-20mmHg at 25°C
• Boiling Point: 692.4°Cat760mmHg
• Flash Point: 372.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 8
• Exact Mass: 818.1362245
• Heavy Atom Count: 54
• Complexity: 1310

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O.CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)O)C
• Isomeric SMILES: CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O.CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)C(=O)O)C