Xanthylium, 3,6-bis(diethylamino)-9-(2,4-disulfophenyl)-, inner salt

CAS Registry Number®

2609-88-3
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CAS Name

Xanthylium, 3,6-bis(diethylamino)-9-(2,4-disulfophenyl)-, inner salt

Molecular Formula

C27H30N2O7S2

Cite this Page

Xanthylium, 3,6-bis(diethylamino)-9-(2,4-disulfophenyl)-, inner salt.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2609-88-3 (retrieved 2024-04-28) (CAS RN: 2609-88-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H30N2O7S2/c1-5-28(6-2)18-9-12-21-24(15-18)36-25-16-19(29(7-3)8-4)10-13-22(25)27(21)23-14-11-20(37(30,31)32)17-26(23)38(33,34)35/h9-17H,5-8H2,1-4H3,(H-,30,31,32,33,34,35)

InChIKey

InChIKey=IOOMXAQUNPWDLL-UHFFFAOYSA-N

SMILES

S(=O)(=O)([O-])C1=C(C=2C3=C([O+]=C4C2C=CC(N(CC)CC)=C4)C=C(N(CC)CC)C=C3)C=CC(S(=O)(=O)O)=C1

Canonical SMILES

O=S(=O)([O-])C=1C=C(C=CC1C=2C=3C=CC(=CC3[O+]=C4C=C(C=CC42)N(CC)CC)N(CC)CC)S(=O)(=O)O

Other Names for this Substance

  • Xanthylium, 3,6-bis(diethylamino)-9-(2,4-disulfophenyl)-, inner salt
  • Ammonium, [6-(diethylamino)-9-(2,4-disulfophenyl)-3H-xanthen-3-ylidene]diethyl-, hydroxide, inner salt
  • Xanthylium, 3,6-bis(diethylamino)-9-(2,4-disulfophenyl)-, hydroxide, inner salt
  • [6-(Diethylamino)-9-(2,4-disulfophenyl)-3H-xanthen-3-ylidene]diethylammonium hydroxide, inner salt
  • Neolan Red E-XB 400 FA

Deleted or Replaced CAS Registry Numbers

10090-50-3, 127648-55-9, 226423-67-2, 1107693-26-4, 1108791-82-7, 1803337-74-7, 2567860-20-0

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