2-[carboxymethyl-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]amino]acetic acid
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![2-[carboxymethyl-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]amino]acetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/77456b20de174f2ea9e09f25989d72d0.png "2-[carboxymethyl-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]amino]acetic acid")
2-[carboxymethyl-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]amino]acetic acid
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CAS No:
565166-40-7
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Formula:
C8H8F3NO5
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Chemical Name:
2-[carboxymethyl-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]amino]acetic acid
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Synonyms:
[Carboxymethyl-(4,4,4-trifluoro-3-oxo-but-1-enyl)-amino]-acetic acid;2-[(carboxymethyl)(4,4,4-trifluoro-3-oxobut-1-en-1-yl)amino]acetic acid;565166-40-7;ZINC3273934;2-[carboxymethyl-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]amino]acetic acid;AKOS000114590;NE49871;NCGC00337771-01;EN300-00194;AB01329466-02;2-[(carboxymethyl)[(1E)-4,4,4-trifluoro-3-oxobut-1-en-1-yl]amino]acetic acid
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CAS No:
2-[carboxymethyl-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]amino]acetic acid Basic Attributes
255.15 g/mol
255.03545684 g/mol
Computed Properties
Molecular Weight:255.15
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:255.03545684
Monoisotopic Mass:255.03545684
Topological Polar Surface Area:94.9
Heavy Atom Count:17
Complexity:334
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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