2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid
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![2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f9118bc0cc9d4bb4b5b9acfecf87cefe.png "2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid")
2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid
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CAS No:
52748-86-4
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Formula:
C23H26N2O3S
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Chemical Name:
2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid
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Synonyms:
Leucoberbelin blue I;52748-86-4;2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid;Leuco berbelin blue I;SCHEMBL13817789;DTXSID00328670;ZINC4520956;Leucoberbelin Blue I, Dye content 65 %;J3.493.866K;Benzenesulfonic acid, 2-[bis[4-(dimethylamino)phenyl]methyl]-
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CAS No:
2-[bis[4-(dimethylamino)phenyl]methyl]benzenesulfonic acid Basic Attributes
410.5 g/mol
410.16641387 g/mol
DTXSID00328670
Safety Information
|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:410.5
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:410.16641387
Monoisotopic Mass:410.16641387
Topological Polar Surface Area:69.2
Heavy Atom Count:29
Complexity:572
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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