6,15-Dimethoxybenzo[rst]Phenanthro[10,1,2-cde]Pentaphene-9,18-Dione
[CAS# 4430-55-1]

Identification

• Name: 6,15-Dimethoxybenzo[rst]Phenanthro[10,1,2-cde]Pentaphene-9,18-Dione
• Synonyms: 2-[(1,3-Benzodioxol-5-Yl-Oxomethyl)Amino]-5,6-Dihydro-4H-Cyclopenta[D]Thiophene-3-Carboxylic Acid Methyl Ester; 2-(1,3-Benzodioxole-5-Carbonylamino)-5,6-Dihydro-4H-Cyclopenta[D]Thiophene-3-Carboxylic Acid Methyl Ester; Methyl 2-(1,3-Benzodioxol-5-Ylcarbonylamino)-5,6-Dihydro-4H-Cyclopenta[D]Thiophene-3-Carboxylate
• Molecular Formula: C₁₇H₁₅NO₅S
• Molecular Weight: 345.37
• CAS Registry Number: 4430-55-1
• EINECS: 224-626-0
• SMILES: C3=C(C(=O)NC1=C(C2=C(S1)CCC2)C(OC)=O)C=CC4=C3OCO4
• InChI: 1S/C17H15NO5S/c1-21-17(20)14-10-3-2-4-13(10)24-16(14)18-15(19)9-5-6-11-12(7-9)23-8-22-11/h5-7H,2-4,8H2,1H3,(H,18,19)
• InChIKey: NVLLGPKKSLSYHK-UHFFFAOYSA-N

Properties

• Density: 1.464g/cm³ (Cal.)
• Boiling point: 478.135°C at 760 mmHg (Cal.)
• Flash point: 242.967°C (Cal.)