7-{[Bis(2-Chloroethyl)Amino]Methyl}-6-Hydroxy-2H-Naphtho[1,8-Bc]Furan-2-One

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Formula C16H15Cl2NO3
IUPAC Name 10-[bis(2-chloroethyl)aminomethyl]-9-hydroxy-2-oxatricyclo[6.3.1.04,12]dodeca-1(12),4,6,8,10-pentaen-3-one
Molecular Mass 340.201 g·mol−1
Heat of Formation -374.8 ± 16.7 kJ·mol−1
Dipole Moment 3.52 ± 1.08 D
Volume 372.74 Å 3
Surface Area 319.82 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy 1.57 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-naphtho(1,8-bc)furan-2-one, 7-((bis(2-chloroethyl)amino)ethyl)-6-hydroxy-
  • 5-hcanc
  • 5-hydroxy-6-(n,n-bis(2-chloroethyl)aminomethyl)naphthalene-1,8-carbolactone
CAS Number(s)
  • 134274-45-6
InChIKey FFEJZWZVRIARDK-UHFFFAOYSA-N
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Elements H C N O Cl