1-(4-Chloro-1-Oxo-3-Propoxy-1H-Isochromen-7-Yl)-3-Phenylurea

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Properties Simple | Detailed

Formula C19H18ClN2O4+
IUPAC Name 1-(4-chloro-1-oxo-3-propoxy-isochromen-7-yl)-3-phenyl-urea
Molecular Mass 373.810 g·mol−1
Heat of Formation -477.8 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 407.1 Å 3
Surface Area 381.01 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy 2.06 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(4-chloro-1-keto-3-propoxy-isochromen-7-yl)-3-phenyl-urea
  • 1-(4-chloro-1-oxo-3-propoxy-7-isochromenyl)-3-phenylurea
  • 7-phenylureido-4-chloro-3-propyloxyisocoumarin
  • n-(4-chloro-1-oxo-3-propoxy-1h-isochromen-7-yl)-n'-phenylurea
InChIKey NTIRQLXQCVZDJU-UHFFFAOYSA-N
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Elements H C N O Cl