Benzanthracene-8,9-oxide structure

Benzanthracene-8,9-oxide

5-oxapentacyclo[9.8.0.03,9.04,6.012,17]nonadeca-1,3(9),7,10,12,14,16,18-octaene

CAS: 34501-55-8
Molecular Formula C18H12O
Molecular Weight 244.3 g/mol
LogP 4.3
Topological Polar Surface Area 12.5 A2
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
Rotatable Bonds 0
Exact Mass 244.08882
Heavy Atoms 19
Complexity 400.0

Chemical Identifiers

CAS Number 34501-55-8
SMILES C1=CC=C2C(=C1)C=CC3=CC4=C(C=CC5C4O5)C=C32
InChIKey SVKZFXAHKUJFBQ-UHFFFAOYSA-N

📖 Product Overview

Benzanthracene-8,9-oxide (CAS: 34501-55-8) is a chemical compound with molecular formula C18H12O and molecular weight 244.3 g/mol. Its IUPAC systematic name is 5-oxapentacyclo[9.8.0.03,9.04,6.012,17]nonadeca-1,3(9),7,10,12,14,16,18-octaene. LogP 4.3 Topological Polar Surface Area 12.5 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 1 Rotatable Bonds 0 Exact Mass 244.08882 Heavy Atoms 19 Complexity 400.0 InChI Key: SVKZFXAHKUJFBQ-UHFFFAOYSA-N. SMILES: C1=CC=C2C(=C1)C=CC3=CC4=C(C=CC5C4O5)C=C32.

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