7,12-dimethylbenzo[a]anthracene-4-sulfonic acid
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![7,12-dimethylbenzo[a]anthracene-4-sulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d3475d47c72b4ca5b0b3579fde9fd296.png "7,12-dimethylbenzo[a]anthracene-4-sulfonic acid")
7,12-dimethylbenzo[a]anthracene-4-sulfonic acid
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CAS No:
125165-59-5
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Formula:
C20H16O3S
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Chemical Name:
7,12-dimethylbenzo[a]anthracene-4-sulfonic acid
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Synonyms:
DMBA-4-sulfonic acid;125165-59-5;DTXSID30154686
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CAS No:
7,12-dimethylbenzo[a]anthracene-4-sulfonic acid Basic Attributes
336.4 g/mol
336.08201554 g/mol
DTXSID30154686
Computed Properties
Molecular Weight:336.4
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:336.08201554
Monoisotopic Mass:336.08201554
Topological Polar Surface Area:62.8
Heavy Atom Count:24
Complexity:566
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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