3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl-methyl-dipropylazanium;4-methylbenzenesulfonate
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![3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl-methyl-dipropylazanium;4-methylbenzenesulfonate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/4325fbf914e343aa8dd12a5ec6d71963.png "3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl-methyl-dipropylazanium;4-methylbenzenesulfonate")
3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl-methyl-dipropylazanium;4-methylbenzenesulfonate
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CAS No:
13002-45-4
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Formula:
C30H41NO5S
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Chemical Name:
3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl-methyl-dipropylazanium;4-methylbenzenesulfonate
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Synonyms:
13002-45-4;2-(3-(Dipropylamino)propoxy)benzhydrol methyl toluenesulfonate;Benzhydrol, 2-(3-(dipropylamino)propoxy)-, methyl toluenesulfonate;Ammonium, dipropyl(3-(2-(alpha-hydroxybenzyl)phenoxy)propyl)methyl-, toluenesulfonate;Dipropyl(3-(2-(alpha-hydroxybenzyl)phenoxy)propyl)methylammonium toluenesulfonate;DTXSID60926570;3-{2-[Hydroxy(phenyl)methyl]phenoxy}-N-methyl-N,N-dipropylpropan-1-aminium 4-methylbenzene-1-sulfonate
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CAS No:
3-[2-[hydroxy(phenyl)methyl]phenoxy]propyl-methyl-dipropylazanium;4-methylbenzenesulfonate Basic Attributes
527.7 g/mol
527.27054458 g/mol
Computed Properties
Molecular Weight:527.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:11
Exact Mass:527.27054458
Monoisotopic Mass:527.27054458
Topological Polar Surface Area:95
Heavy Atom Count:37
Complexity:554
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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