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3-[dimethyl-[4-[(E)-3-phenylprop-2-enoxy]but-2-ynyl]azaniumyl]propane-1-sulfonate
3-[dimethyl-[4-[(E)-3-phenylprop-2-enoxy]but-2-ynyl]azaniumyl]propane-1-sulfonate
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![3-[dimethyl-[4-[(E)-3-phenylprop-2-enoxy]but-2-ynyl]azaniumyl]propane-1-sulfonate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f5f15f1742f34ae8b947ef75433a5508.png "3-[dimethyl-[4-[(E)-3-phenylprop-2-enoxy]but-2-ynyl]azaniumyl]propane-1-sulfonate")
3-[dimethyl-[4-[(E)-3-phenylprop-2-enoxy]but-2-ynyl]azaniumyl]propane-1-sulfonate
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CAS No:
259801-40-6
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Formula:
C18H25NO4S
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Chemical Name:
3-[dimethyl-[4-[(E)-3-phenylprop-2-enoxy]but-2-ynyl]azaniumyl]propane-1-sulfonate
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Synonyms:
STL331678;AKOS001644336;3-[dimethyl(4-{[(2E)-3-phenylprop-2-enyl]oxy}but-2-ynyl)ammonio]propane-1-sulfonate;259801-40-6;3-[dimethyl(4-{[(2E)-3-phenylprop-2-en-1-yl]oxy}but-2-yn-1-yl)ammonio]propane-1-sulfonate
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CAS No:
3-[dimethyl-[4-[(E)-3-phenylprop-2-enoxy]but-2-ynyl]azaniumyl]propane-1-sulfonate Basic Attributes
351.5 g/mol
351.15042945 g/mol
Computed Properties
Molecular Weight:351.5
XLogP3:1.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:351.15042945
Monoisotopic Mass:351.15042945
Topological Polar Surface Area:74.8
Heavy Atom Count:24
Complexity:529
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-[dimethyl-[4-[(E)-3-phenylprop-2-enoxy]but-2-ynyl]azaniumyl]propane-1-sulfonate
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