3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxepin-5-one
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3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxepin-5-one
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CAS No:
22891-54-9
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Formula:
C10H10O4
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Chemical Name:
3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxepin-5-one
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Synonyms:
2,3-Dihydro-3-(hydroxymethyl)-5H-1,4-benzodioxepin-5-one;22891-54-9;3-hydroxymethyl-2,3-dihydro-benzo[e][1,4]dioxepin-5-one;BRN 1427972;5H-1,4-BENZODIOXEPIN-5-ONE, 2,3-DIHYDRO-3-(HYDROXYMETHYL)-;DTXSID70945570;3-(Hydroxymethyl)-2,3-dihydro-5H-1,4-benzodioxepin-5-one
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CAS No:
3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxepin-5-one Basic Attributes
194.18 g/mol
194.05790880 g/mol
Computed Properties
Molecular Weight:194.18
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:194.05790880
Monoisotopic Mass:194.05790880
Topological Polar Surface Area:55.8
Heavy Atom Count:14
Complexity:216
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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