Peroxyacetic acid uroporphyrin I
[CAS# 134773-19-6]

Identification

• Name: Peroxyacetic acid uroporphyrin I
• Synonyms: Peroxyacetic Acid Uroporphyrin I
• Molecular Formula: C₅₄H₆₆N₄O₁₇
• Molecular Weight: 1043.13
• CAS Registry Number: 134773-19-6
• SMILES: C(C2=C(C3=CC5=NC(=CC4=NC(=CC1=C(C(=C([NH]1)C=C2[NH]3)CC(OCC)=O)CCC(OCC)=O)C(=C4CCC(OCC)=O)CC(OCC)=O)C(=C5CCC(OCC)=O)CC(OO)=O)CC(OCC)=O)CC(OCC)=O
• InChI: 1S/C54H66N4O17/c1-8-68-47(59)19-15-31-35(23-51(63)72-12-5)43-27-40-32(16-20-48(60)69-9-2)36(24-52(64)73-13-6)45(56-40)29-42-34(18-22-50(62)71-11-4)38(26-54(66)75-67)46(58-42)30-41-33(17-21-49(61)70-10-3)37(25-53(65)74-14-7)44(57-41)28-39(31)55-43/h27-30,55-56,67H,8-26H2,1-7H3
• InChIKey: KLYCXBRBYHTKKX-UHFFFAOYSA-N

Properties

• Density: 1.264g/cm³ (Cal.)
• Boiling point: 1209.88°C at 760 mmHg (Cal.)
• Flash point: 685.511°C (Cal.)