4-methylsulfanyl-2-[2-(2,4,5-trichlorophenoxy)propanoylamino]butanoic acid
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![4-methylsulfanyl-2-[2-(2,4,5-trichlorophenoxy)propanoylamino]butanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/869488338119485f868e606a8dab1cf5.png "4-methylsulfanyl-2-[2-(2,4,5-trichlorophenoxy)propanoylamino]butanoic acid")
4-methylsulfanyl-2-[2-(2,4,5-trichlorophenoxy)propanoylamino]butanoic acid
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CAS No:
7144-00-5
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Formula:
C14H16Cl3NO4S
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Chemical Name:
4-methylsulfanyl-2-[2-(2,4,5-trichlorophenoxy)propanoylamino]butanoic acid
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Synonyms:
5447-12-1;7144-00-5;NSC16774;n-[2-(2,4,5-trichlorophenoxy)propanoyl]methionine;DTXSID10991834;DTXSID20280428;NSC16773;NSC-16773;NSC-16774;N-[1-Hydroxy-2-(2,4,5-trichlorophenoxy)propylidene]methionine
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CAS No:
4-methylsulfanyl-2-[2-(2,4,5-trichlorophenoxy)propanoylamino]butanoic acid Basic Attributes
400.7 g/mol
398.986562 g/mol
16774|16773
DTXSID20280428
Computed Properties
Molecular Weight:400.7
XLogP3:4.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:398.986562
Monoisotopic Mass:398.986562
Topological Polar Surface Area:101
Heavy Atom Count:23
Complexity:416
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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