(2R)-2,4-Dihydroxy-7-Methoxy-2H-1,4-Benzoxazin-3(4H)-One

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Properties Simple | Detailed

Formula C9H9NO5
IUPAC Name (2r)-2,4-dihydroxy-7-methoxy-1,4-benzoxazin-3-one
Molecular Mass 211.171 g·mol−1
Heat of Formation -587.8 ± 16.7 kJ·mol−1
Dipole Moment 4.40 ± 1.08 D
Volume 222.58 Å 3
Surface Area 214.55 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2,4-dihydroxy-7-methoxy-1,4-benzoxazin-3-one
  • 2,4-dihydroxy-7-(methyloxy)-2h-1,4-benzoxazin-3(4h)-one
  • hbo
InChIKey GDNZNIJPBQATCZ-SECBINFHSA-N
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