(2S,3R)-4-methylidene-5-oxo-2-pentyloxolane-3-carboxylic acid
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(2S,3R)-4-methylidene-5-oxo-2-pentyloxolane-3-carboxylic acid
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CAS No:
112923-53-2
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Formula:
C11H16O4
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Chemical Name:
(2S,3R)-4-methylidene-5-oxo-2-pentyloxolane-3-carboxylic acid
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Synonyms:
3-carboxy-2-methylene-4-nonanolide;methylenolactocin;112923-53-2;3-Carboxy-2-methylene-4-nonanolide;(2S,3R)-4-methylidene-5-oxo-2-pentyloxolane-3-carboxylic acid;(-)-Methylenolactocin;DTXSID40920955;4-methylidene-5-oxo-2-pentyloxolane-3-carboxylic acid;3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-pentyl-, trans-(-)-
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CAS No:
(2S,3R)-4-methylidene-5-oxo-2-pentyloxolane-3-carboxylic acid Basic Attributes
212.24 g/mol
212.10485899 g/mol
Computed Properties
Molecular Weight:212.24
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:212.10485899
Monoisotopic Mass:212.10485899
Topological Polar Surface Area:63.6
Heavy Atom Count:15
Complexity:282
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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