Dimethylbenz(a)anthracene-8,9-diol-10,11-epoxide

(4S,7S,8R)-2,10-dimethyl-5-oxapentacyclo[9.8.0.03,9.04,6.014,19]nonadeca-1,3(9),10,12,14,16,18-heptaene-7,8-diol

CAS: 65763-31-7

Molecular Formula	`C20H18O3`
Molecular Weight	306.4 g/mol
LogP	3.0
Topological Polar Surface Area	53.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	0
Exact Mass	306.12558
Heavy Atoms	23
Complexity	480.0

Chemical Identifiers

CAS Number	65763-31-7
SMILES	`CC1=C2C=CC3=CC=CC=C3C2=C(C4=C1C(C(C5C4O5)O)O)C`
InChIKey	`HPHSHHQQIRFIJX-QYRWZOIFSA-N`

📖 Product Overview

Dimethylbenz(a)anthracene-8,9-diol-10,11-epoxide (CAS: 65763-31-7) is a chemical compound with molecular formula C20H18O3 and molecular weight 306.4 g/mol. Its IUPAC systematic name is (4S,7S,8R)-2,10-dimethyl-5-oxapentacyclo[9.8.0.03,9.04,6.014,19]nonadeca-1,3(9),10,12,14,16,18-heptaene-7,8-diol. LogP 3.0 Topological Polar Surface Area 53.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 0 Exact Mass 306.12558 Heavy Atoms 23 Complexity 480.0 InChI Key: HPHSHHQQIRFIJX-QYRWZOIFSA-N. SMILES: CC1=C2C=CC3=CC=CC=C3C2=C(C4=C1C(C(C5C4O5)O)O)C.

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