Tetrabromophenol blue

CAS Registry Number®

4430-25-5

CAS Name

Tetrabromophenol blue

Molecular Formula

C19H6Br8O5S

Molecular Mass

985.54

Cite this Page

Tetrabromophenol blue.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4430-25-5 (retrieved 2024-11-25) (CAS RN: 4430-25-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H6Br8O5S/c20-7-1-5(2-8(21)16(7)28)19(6-3-9(22)17(29)10(23)4-6)11-12(24)13(25)14(26)15(27)18(11)33(30,31)32-19/h1-4,28-29H

InChIKey

InChIKey=QPMIVFWZGPTDPN-UHFFFAOYSA-N

SMILES

BrC1=C2C(OS(=O)(=O)C2=C(Br)C(Br)=C1Br)(C3=CC(Br)=C(O)C(Br)=C3)C4=CC(Br)=C(O)C(Br)=C4

Canonical SMILES

O=S1(=O)OC(C2=CC(Br)=C(O)C(Br)=C2)(C3=CC(Br)=C(O)C(Br)=C3)C=4C(Br)=C(Br)C(Br)=C(Br)C41

Other Names for this Substance

  • Phenol, 4,4′-(4,5,6,7-tetrabromo-1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2,6-dibromo-
  • Phenol, 4,4′-(4,5,6,7-tetrabromo-3H-2,1-benzoxathiol-3-ylidene)bis[2,6-dibromo-, S,S-dioxide
  • Tetrabromophenol blue
  • 3H-2,1-Benzoxathiole, phenol deriv.
  • 4,4′-(4,5,6,7-Tetrabromo-1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2,6-dibromophenol]

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Deleted or Replaced CAS Registry Numbers

5415-34-9, 61053-98-3, 68460-00-4

CAS INSIGHTSTM
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