(1R,2R,3S,4S,5S)-5-ethoxycarbonyl-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid
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![(1R,2R,3S,4S,5S)-5-ethoxycarbonyl-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0b59ac82f00d4a2cb5f0f80f26b88639.png "(1R,2R,3S,4S,5S)-5-ethoxycarbonyl-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid")
(1R,2R,3S,4S,5S)-5-ethoxycarbonyl-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid
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CAS No:
127331-49-1
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Formula:
C11H14O7
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Chemical Name:
(1R,2R,3S,4S,5S)-5-ethoxycarbonyl-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid
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Synonyms:
127331-49-1;5-endo-(Ethoxycarbonyl)endothall;5-Ethyl 7-oxabicyclo(2.2.1)heptane-2,3,5-tricarboxylate (2-exo,3-exo,5-endo)-;7-Oxabicyclo(2.2.1)heptane-2,3,5-tricarboxylic acid, 5-ethyl ester, (2-exo,3-exo,5-endo)-;DTXSID80925863;5-(Ethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid
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CAS No:
(1R,2R,3S,4S,5S)-5-ethoxycarbonyl-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid Basic Attributes
258.22 g/mol
258.07395278 g/mol
Computed Properties
Molecular Weight:258.22
XLogP3:-0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:258.07395278
Monoisotopic Mass:258.07395278
Topological Polar Surface Area:110
Heavy Atom Count:18
Complexity:391
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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