C.I. Reactive Brown 10

CAS Registry Number®

70788-63-5

CAS Name

C.I. Reactive Brown 10

Molecular Formula

C40H18Cl4CrN12O12S2.H.2Na

Cite this Page

C.I. Reactive Brown 10.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=12225-67-1 (retrieved 2024-11-24) (CAS RN: 70788-63-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/2C20H12Cl2N6O6S.Cr.2Na/c2*21-18-24-19(22)26-20(25-18)23-10-5-6-11-9(7-10)8-14(35(32,33)34)15(16(11)29)28-27-13-4-2-1-3-12(13)17(30)31;;;/h2*1-8,29H,(H,30,31)(H,32,33,34)(H,23,24,25,26);;;/q;;+3;2*+1/p-5

InChIKey

InChIKey=GRQJWISCNBOZMB-UHFFFAOYSA-I

SMILES

O=C1[O-][Cr+3]234([N](C=5C(C(=O)[O-]2)=CC=CC5)=NC=6C([O-]3)=C7C(=CC6S(=O)(=O)[O-])C=C(NC=8N=C(Cl)N=C(Cl)N8)C=C7)[N](C=9C1=CC=CC9)=NC=%10C([O-]4)=C%11C(=CC%10S(=O)(=O)[O-])C=C(NC=%12N=C(Cl)N=C(Cl)N%12)C=C%11.[H+].[Na+]

Canonical SMILES

[H+].[Na+].O=C1[O-][Cr+3]234([O-]C(=O)C=5C=CC=CC5[N]3=NC=6C([O-]2)=C7C=CC(=CC7=CC6S(=O)(=O)[O-])NC=8N=C(Cl)N=C(Cl)N8)[O-]C=9C(N=[N]4C=%10C=CC=CC1%10)=C(C=C%11C=C(C=CC%119)NC=%12N=C(Cl)N=C(Cl)N%12)S(=O)(=O)[O-]

Other Names for this Substance

  • Chromate(3-), bis[2-[2-[6-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-1-(hydroxy-κO)-3-sulfo-2-naphthalenyl]diazenyl-κN1]benzoato(3-)-κO]-, sodium hydrogen (1:2:1)
  • Chromate(3-), bis[2-[[6-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-1-hydroxy-3-sulfo-2-naphthalenyl]azo]benzoato(3-)]-, disodium hydrogen
  • Benzoic acid, 2-[[6-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-1-hydroxy-3-sulfo-2-naphthalenyl]azo]-, chromium complex
  • C.I. Reactive Brown 10
  • Mikacion Red Brown 4RS

View All

Deleted or Replaced CAS Registry Numbers

12225-67-1

CAS INSIGHTSTM
Hourglass and a clock