1-Carboxyethyl butanoate
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1-Carboxyethyl butanoate
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CAS No:
84681-86-7
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Formula:
C7H12O4
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Chemical Name:
1-Carboxyethyl butanoate
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Synonyms:
Butanoic acid,1-carboxyethyl ester;1-Carboxyethyl butanoate;O-Butyroyllactic acid;2-(Butanoyloxy)propanoic acid;2-(Butyryloxy)propanoic acid
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CAS No:
Computed Properties
Molecular Weight:160.17
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:160.07355886
Monoisotopic Mass:160.07355886
Topological Polar Surface Area:63.6
Heavy Atom Count:11
Complexity:153
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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