3-Chloro-6-Decyl-5-Hydroxy-4-Methyl-1,2-Benzoquinone

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Properties Simple | Detailed

Formula C17H25ClO3
IUPAC Name 3-chloro-6-decyl-5-hydroxy-4-methyl-1,2-benzoquinone
Molecular Mass 312.832 g·mol−1
Heat of Formation -590.1 ± 16.7 kJ·mol−1
Dipole Moment 6.01 ± 1.08 D
Volume 393.4 Å 3
Surface Area 368.24 Å 2
HOMO Energy -9.61 ± 0.55 eV
LUMO Energy -1.89 ± eV
Point Group Symmetry C1
Synonyms
  • 3-chloro-5-hydroxy-2-methyl-6-decyl-1,4-benzoquinone
  • 3-chloro-6-decyl-5-hydroxy-4-methyl-cyclohexa-3,5-diene-1,2-dione
  • 3-chloro-6-decyl-5-hydroxy-4-methyl-o-benzoquinone
  • 3-chloro-6-decyl-5-hydroxy-4-methylcyclohexa-3,5-diene-1,2-dione
  • 3-chmdb
CAS Number(s)
  • 120559-62-8
InChIKey YWYPMZPMAVGPHK-UHFFFAOYSA-N
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