4,4'-(1,1-Dioxido-3H-2,1-Benzoxathiole-3,3-Diyl)Bis(2-Bromo-6-Chlorophenol)

Molecule SVG Image

Properties Simple | Detailed

Formula C19H10Br2Cl2O5S
IUPAC Name 2-bromo-4-[3-(3-bromo-5-chloro-4-hydroxy-phenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]-6-chloro-phenol
Molecular Mass 581.059 g·mol−1
Heat of Formation -554.6 ± 16.7 kJ·mol−1
Dipole Moment 5.08 ± 1.08 D
Volume 482.34 Å 3
Surface Area 401.06 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -1.42 ± eV
Point Group Symmetry C1
Synonyms
  • 2-bromo-4-[3-(3-bromo-5-chloro-4-hydroxy-phenyl)-1,1-diketo-benzo[c]oxathiol-3-yl]-6-chloro-phenol
  • 2-bromo-4-[3-(3-bromo-5-chloro-4-hydroxy-phenyl)-1,1-dioxo-benzo[c][1,2]oxathiol-3-yl]-6-chloro-phenol
  • 2-bromo-4-[3-(3-bromo-5-chloro-4-hydroxy-phenyl)-1,1-dioxo-benzo[c]oxathiol-3-yl]-6-chloro-phenol
  • 2-bromo-4-[3-(3-bromo-5-chloro-4-hydroxyphenyl)-1,1-dioxo-3-benzo[c]oxathiolyl]-6-chlorophenol
  • 2-bromo-4-[3-(3-bromo-5-chloro-4-hydroxyphenyl)-1,1-dioxobenzo[c]oxathiol-3-yl]-6-chlorophenol
  • 3',3''-dibromo-5',5''-dichlorophenolsulfonephthalein
  • 4,4'-(3h-2,1-benzoxathiol-3-ylidene)bis(2-bromo-6-chlorophenol) s,s-dioxide
  • bromchlorophenol blue
  • bromochlorophenol blue
  • bromochlorophenol blue;bromchlorophenol blue
  • phenol, 4,4'-(3h-2,1-benzoxathiol-3-ylidene)bis(2-bromo-6-chloro-, s,s-dioxide (8ci)(9ci)
  • phenol, 4,4'-(3h-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-chloro-, s,s-dioxide
  • phenol,4,4'-(3h-2,1-benzoxathiol-3-ylidene)bis[2-bromo-6-chloro-, s,s-dioxide(8ci9ci)
CAS Number(s)
  • 2553-71-1
InChIKey MDGFKZKMIQQRPU-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Cl H O S Br