Diphenylmethyl (6S,7S)-7-amino-3-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride (1:1)
[CAS# 71613-81-5]

Identification

• Name: Diphenylmethyl (6S,7S)-7-amino-3-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate hydrochloride (1:1)
• Synonyms: diphenylmethyl (6R-trans)-7-amino-3-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate monohydrochloride
• Molecular Formula: C₂₁H₂₁ClN₂O₄S
• Molecular Weight: 432.92
• CAS Registry Number: 71613-81-5
• EINECS: 275-696-4
• SMILES: Cl.O=C1[C@H](N)[C@@H]2SCC(OC)=C(N12)C(=O)OC(c3ccccc3)c4ccccc4
• InChI: 1S/C21H20N2O4S.ClH/c1-26-15-12-28-20-16(22)19(24)23(20)17(15)21(25)27-18(13-8-4-2-5-9-13)14-10-6-3-7-11-14;/h2-11,16,18,20H,12,22H2,1H3;1H/t16-,20-;/m0./s1
• InChIKey: OIVHUILIEOUDTL-XXRBRTKDSA-N

Properties

• Boiling point: 649.5°C at 760 mmHg (Cal.)
• Flash point: 346.6°C (Cal.)