2-(benzo[b]pyren-6-ylmethylamino)-2-methylpropane-1,3-diol;methanesulfonic acid
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![2-(benzo[b]pyren-6-ylmethylamino)-2-methylpropane-1,3-diol;methanesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b5167f8696934a93b35d0ba6b163e0ac.png "2-(benzo[b]pyren-6-ylmethylamino)-2-methylpropane-1,3-diol;methanesulfonic acid")
2-(benzo[b]pyren-6-ylmethylamino)-2-methylpropane-1,3-diol;methanesulfonic acid
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CAS No:
104525-00-0
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Formula:
C26H27NO5S
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Chemical Name:
2-(benzo[b]pyren-6-ylmethylamino)-2-methylpropane-1,3-diol;methanesulfonic acid
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Synonyms:
1,3-Propanediol, 2-((benzo(a)pyren-6-ylmethyl)amino)-2-methyl-, methanesulfonate (salt);104525-00-0;2-((Benzo(a)pyren-6-ylmethyl)amino)-2-methyl-1,3-propanediol methanesulfonate (salt);2-((Benzo(a)pyren-6-ylmethyl)amino)-2-methyl-1,3-propanediol methanesulfonate;SCHEMBL10349448;DTXSID50146528
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CAS No:
2-(benzo[b]pyren-6-ylmethylamino)-2-methylpropane-1,3-diol;methanesulfonic acid Basic Attributes
465.6 g/mol
465.16099414 g/mol
DTXSID50146528
Computed Properties
Molecular Weight:465.6
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:465.16099414
Monoisotopic Mass:465.16099414
Topological Polar Surface Area:115
Heavy Atom Count:33
Complexity:639
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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