1-[4-(3-dimethylsulfoniopropanoylamino)phenoxy]-3-ethoxypropan-2-olate
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1-[4-(3-dimethylsulfoniopropanoylamino)phenoxy]-3-ethoxypropan-2-olate
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CAS No:
127519-21-5
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Formula:
C16H25NO4S
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Chemical Name:
1-[4-(3-dimethylsulfoniopropanoylamino)phenoxy]-3-ethoxypropan-2-olate
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Synonyms:
127519-21-5;DTXSID00925906;Sulfonium, (3-((4-(3-ethoxy-2-hydroxypropoxy)propyl)amino)-3-oxopropyl)dimethyl-, inner salt;1-{4-[3-(Dimethylsulfaniumyl)propanamido]phenoxy}-3-ethoxypropan-2-olate
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CAS No:
1-[4-(3-dimethylsulfoniopropanoylamino)phenoxy]-3-ethoxypropan-2-olate Basic Attributes
327.4 g/mol
327.15042945 g/mol
Computed Properties
Molecular Weight:327.4
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:10
Exact Mass:327.15042945
Monoisotopic Mass:327.15042945
Topological Polar Surface Area:71.6
Heavy Atom Count:22
Complexity:307
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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