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7,12-dimethylbenzo[a]anthracene-5,6-diol

7,12-dimethylbenzo[a]anthracene-5,6-diol structure

CAS No:
16033-60-6
Formula:
C20H16O2
Chemical Name:
7,12-dimethylbenzo[a]anthracene-5,6-diol
Synonyms:
7,12-Dimethylbenz(a)anthracene-5,6-diol;16033-60-6;Benz(a)anthracene, 5,6-dihydroxy-7,12-dimethyl-;DTXSID30166865;5,6-Dihydroxy-7,12-dimethylbenz[a]anthracene

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7,12-dimethylbenzo[a]anthracene-5,6-diol Basic Attributes

Molecular Weight：

288.3 g/mol

Exact Mass：

288.115029749 g/mol

DSSTox ID：

DTXSID30166865

Characteristics

PSA：

40.5 Å²

Drug Information

Metabolism/Metabolites：

7,12-Dimethylbenz(a)anthracene-5,6-diol is a known human metabolite of 7,12 Dimethylbenzanthracene.

Computed Properties

Molecular Weight:288.3
XLogP3:5.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:288.115029749
Monoisotopic Mass:288.115029749
Topological Polar Surface Area:40.5
Heavy Atom Count:22
Complexity:409
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7,12-dimethylbenzo[a]anthracene-5,6-diol

Basic Attributes
Characteristics
Drug Information
Computed Properties

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