Penicillin Bt
[CAS# 6192-29-6]

Identification

• Name: Penicillin Bt
• Synonyms: (2S,5R,6R)-6-[[2-(Butylthio)-1-Oxoethyl]Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; (2S,5R,6R)-6-[[2-(Butylthio)Acetyl]Amino]-7-Keto-3,3-Dimethyl-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; (2S,5R,6R)-6-(2-Butylsulfanylethanoylamino)-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid
• Molecular Formula: C₁₄H₂₂N₂O₄S₂
• Molecular Weight: 346.46
• CAS Registry Number: 6192-29-6
• SMILES: [C@H]1(N2[C@H](SC1(C)C)[C@@H](C2=O)NC(=O)CSCCCC)C(=O)O
• InChI: 1S/C14H22N2O4S2/c1-4-5-6-21-7-8(17)15-9-11(18)16-10(13(19)20)14(2,3)22-12(9)16/h9-10,12H,4-7H2,1-3H3,(H,15,17)(H,19,20)/t9-,10+,12-/m1/s1
• InChIKey: AMZJKFHHVQNUPT-JFGNBEQYSA-N

Properties

• Density: 1.36g/cm³ (Cal.)
• Boiling point: 624.278°C at 760 mmHg (Cal.)
• Flash point: 331.352°C (Cal.)