2,3-dihydroxy-4-methoxy-4-oxobutanoic acid
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2,3-dihydroxy-4-methoxy-4-oxobutanoic acid
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CAS No:
860708-13-0
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Formula:
C5H8O6
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Chemical Name:
2,3-dihydroxy-4-methoxy-4-oxobutanoic acid
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Synonyms:
2,3-dihydroxy-4-methoxy-4-oxobutanoic acid;860708-13-0;Weinsauremethylester;SCHEMBL516220;AKOS026727091;NE33809
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CAS No:
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:164.11
XLogP3:-1.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:164.03208797
Monoisotopic Mass:164.03208797
Topological Polar Surface Area:104
Heavy Atom Count:11
Complexity:164
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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