3,6-Bis(hydroxymethyl)-2-methyl-4H-pyran-4-one
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3,6-Bis(hydroxymethyl)-2-methyl-4H-pyran-4-one
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CAS No:
131123-56-3
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Formula:
C8H10O4
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Chemical Name:
3,6-Bis(hydroxymethyl)-2-methyl-4H-pyran-4-one
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Synonyms:
4H-Pyran-4-one,3,6-bis(hydroxymethyl)-2-methyl-;3,6-Bis(hydroxymethyl)-2-methyl-4H-pyran-4-one;Herierin III;3,6-Bis(hydroxymethyl)-2-methylpyran-4-one
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CAS No:
Computed Properties
Molecular Weight:170.16
XLogP3:-0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:170.05790880
Monoisotopic Mass:170.05790880
Topological Polar Surface Area:66.8
Heavy Atom Count:12
Complexity:262
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3,6-Bis(hydroxymethyl)-2-methyl-4H-pyran-4-one
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