1,2-Dimethyl 2-hydroxy-1,2,3-propanetricarboxylate
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1,2-Dimethyl 2-hydroxy-1,2,3-propanetricarboxylate
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CAS No:
53798-97-3
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Formula:
C8H12O7
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Chemical Name:
1,2-Dimethyl 2-hydroxy-1,2,3-propanetricarboxylate
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Synonyms:
1,2,3-Propanetricarboxylic acid,2-hydroxy-,1,2-dimethyl ester;1,2-Dimethyl 2-hydroxy-1,2,3-propanetricarboxylate;α,β-Dimethylcitrate;NSC 75822;1,2-Dimethyl citrate;3-Hydroxy-5-methoxy-3-(methoxycarbonyl)-5-oxopentanoic acid
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CAS No:
Computed Properties
Molecular Weight:220.18
XLogP3:-1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:220.05830272
Monoisotopic Mass:220.05830272
Topological Polar Surface Area:110
Heavy Atom Count:15
Complexity:272
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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