Dmba endoperoxide structure

Dmba endoperoxide

1,12-dimethyl-19,20-dioxapentacyclo[10.6.2.02,11.03,8.013,18]icosa-2(11),3,5,7,9,13,15,17-octaene

Also Known As: Dmba endoperoxide|7,12-Epidioxybenz(a)anthracene, 7,12-dihydro-7,12-dimethyl-|7,12-Epidioxy-7,12-dimethylbenz(a) anthracene|7,12-dimethyl-7,12-dihydro-7,12-epidioxytetraphene|1,12-dimethyl-19,20-dioxapentacyclo[10.6.2.02,11.03,8.013,18]icosa-2(11),3,5,7,9,13,15,17-octaene

CAS: 6948-02-3
Molecular Formula C20H16O2
Molecular Weight 288.11502 g/mol
LogP 4.3
Topological Polar Surface Area 18.5 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 0
Exact Mass 288.11502
Monoisotopic Mass 288.11502
Heavy Atoms 22
Complexity 463.0

Chemical Identifiers

CAS Number 6948-02-3
SMILES CC12C3=C(C4=CC=CC=C4C=C3)C(C5=CC=CC=C51)(OO2)C
InChIKey PSJYCCGJXUIOCS-UHFFFAOYSA-N

Product Overview

Dmba endoperoxide (CAS 6948-02-3), with molecular formula C20H16O2 and molecular weight 288.11502 g/mol. IUPAC: 1,12-dimethyl-19,20-dioxapentacyclo[10.6.2.02,11.03,8.013,18]icosa-2(11),3,5,7,9,13,15,17-octaene.

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