(2S,3S,4S)-Tetrahydro-4-methyl-5-oxo-2-pentyl-3-furancarboxylic acid
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(2S,3S,4S)-Tetrahydro-4-methyl-5-oxo-2-pentyl-3-furancarboxylic acid
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CAS No:
109667-12-1
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Formula:
C11H18O4
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Chemical Name:
(2S,3S,4S)-Tetrahydro-4-methyl-5-oxo-2-pentyl-3-furancarboxylic acid
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Synonyms:
3-Furancarboxylic acid,tetrahydro-4-methyl-5-oxo-2-pentyl-,(2S,3S,4S)-;3-Furancarboxylic acid,tetrahydro-4-methyl-5-oxo-2-pentyl-,[2S-(2α,3α,4β)]-;(2S,3S,4S)-Tetrahydro-4-methyl-5-oxo-2-pentyl-3-furancarboxylic acid;Phaseolinic acid;(-)-Phaseolinic acid;185258-83-7;203514-26-5
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CAS No:
(2S,3S,4S)-Tetrahydro-4-methyl-5-oxo-2-pentyl-3-furancarboxylic acid Basic Attributes
214.26 g/mol
214.26
Computed Properties
Molecular Weight:214.26
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:214.12050905
Monoisotopic Mass:214.12050905
Topological Polar Surface Area:63.6
Heavy Atom Count:15
Complexity:249
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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