2,4-Dimethyl-7-(2-Methylenebutanoyl)-2H-1,4-Benzoxazin-3(4H)-One

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Properties Simple | Detailed

Formula C15H17NO3
IUPAC Name (2r)-2,4-dimethyl-7-(2-methylenebutanoyl)-1,4-benzoxazin-3-one
Molecular Mass 259.300 g·mol−1
Heat of Formation -373.2 ± 16.7 kJ·mol−1
Dipole Moment 3.62 ± 1.08 D
Volume 314.77 Å 3
Surface Area 287.05 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.78 ± eV
Point Group Symmetry C1
InChIKey KSQWAFPOZRQKCX-SNVBAGLBSA-N
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