3-[4-(2-chloroethylsulfanylmethyl)phenyl]propanoic acid
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![3-[4-(2-chloroethylsulfanylmethyl)phenyl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/38c42b74c0234c9ea99d656dbe5ca65a.png "3-[4-(2-chloroethylsulfanylmethyl)phenyl]propanoic acid")
3-[4-(2-chloroethylsulfanylmethyl)phenyl]propanoic acid
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CAS No:
6951-12-8
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Formula:
C12H15ClO2S
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Chemical Name:
3-[4-(2-chloroethylsulfanylmethyl)phenyl]propanoic acid
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Synonyms:
3-[4-(2-chloroethylsulfanylmethyl)phenyl]propanoic acid
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CAS No:
3-[4-(2-chloroethylsulfanylmethyl)phenyl]propanoic acid Basic Attributes
258.76
258.048
50747
DTXSID40287378
Computed Properties
Molecular Weight:258.76
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:258.0481286
Monoisotopic Mass:258.0481286
Topological Polar Surface Area:62.6
Heavy Atom Count:16
Complexity:203
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-[4-(2-chloroethylsulfanylmethyl)phenyl]propanoic acid
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