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3-[4-benzhydryloxybut-2-ynyl(dimethyl)azaniumyl]propane-1-sulfonate

3-[4-benzhydryloxybut-2-ynyl(dimethyl)azaniumyl]propane-1-sulfonate structure

CAS No:
259801-39-3
Formula:
C22H27NO4S
Chemical Name:
3-[4-benzhydryloxybut-2-ynyl(dimethyl)azaniumyl]propane-1-sulfonate
Synonyms:
STK841191;AKOS001644354;MCULE-5807197518;3-[[4-(benzhydryloxy)but-2-ynyl](dimethyl)ammonio]propane-1-sulfonate;3-{[4-(diphenylmethoxy)but-2-yn-1-yl](dimethyl)ammonio}propane-1-sulfonate;259801-39-3

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3-[4-benzhydryloxybut-2-ynyl(dimethyl)azaniumyl]propane-1-sulfonate Basic Attributes

Molecular Weight：

401.5 g/mol

Exact Mass：

401.16607952 g/mol

Characteristics

PSA：

74.8 Å²

Computed Properties

Molecular Weight:401.5
XLogP3:2.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:401.16607952
Monoisotopic Mass:401.16607952
Topological Polar Surface Area:74.8
Heavy Atom Count:28
Complexity:583
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[4-benzhydryloxybut-2-ynyl(dimethyl)azaniumyl]propane-1-sulfonate

Basic Attributes
Characteristics
Computed Properties

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