4-(hydroxymethyl)-7-methyl-1,3-dioxepane-5,6-diol
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4-(hydroxymethyl)-7-methyl-1,3-dioxepane-5,6-diol
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CAS No:
5399-33-7
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Formula:
C7H14O5
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Chemical Name:
4-(hydroxymethyl)-7-methyl-1,3-dioxepane-5,6-diol
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Synonyms:
4-(hydroxymethyl)-7-methyl-1,3-dioxepane-5,6-diol;5399-33-7;1-Deoxy-2,5-O-methylenehexitol;NSC1352;2,5-Methylene-d,l-rhamnitol;SCHEMBL6672320;DTXSID90277244;NSC-1352;1-Deoxy-2,5-O-methylenehexitol #;NSC403946;NSC403948;NSC-403946;NSC-403948;6-DEOXY-2,5-O-METHYLENE-L-MANNITOL;A833112
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CAS No:
4-(hydroxymethyl)-7-methyl-1,3-dioxepane-5,6-diol Basic Attributes
178.18 g/mol
178.08412354 g/mol
403948|403946|1352
DTXSID90277244
Computed Properties
Molecular Weight:178.18
XLogP3:-1.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:178.08412354
Monoisotopic Mass:178.08412354
Topological Polar Surface Area:79.2
Heavy Atom Count:12
Complexity:140
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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