1,3-Dimethyl 2-[2-(phenylthio)ethyl]propanedioate
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![1,3-Dimethyl 2-[2-(phenylthio)ethyl]propanedioate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/57e0ea63b3644b30866ebf180882615c.png "1,3-Dimethyl 2-[2-(phenylthio)ethyl]propanedioate")
1,3-Dimethyl 2-[2-(phenylthio)ethyl]propanedioate
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CAS No:
84803-47-4
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Formula:
C13H16O4S
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Chemical Name:
1,3-Dimethyl 2-[2-(phenylthio)ethyl]propanedioate
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Synonyms:
Propanedioic acid,2-[2-(phenylthio)ethyl]-,1,3-dimethyl ester;Propanedioic acid,[2-(phenylthio)ethyl]-,dimethyl ester;1,3-Dimethyl 2-[2-(phenylthio)ethyl]propanedioate;NSC 688340
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CAS No:
1,3-Dimethyl 2-[2-(phenylthio)ethyl]propanedioate Basic Attributes
268.33 g/mol
268.33
284-172-4
688340
Computed Properties
Molecular Weight:268.33
XLogP3:2.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:268.07693016
Monoisotopic Mass:268.07693016
Topological Polar Surface Area:77.9
Heavy Atom Count:18
Complexity:258
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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