CAS Registry Number®
84030-63-7
CAS Name
Chromate(1-), bis[2-[[1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]benzoato(2-)]-, hydrogen, compd. with 2-aminoethanol (1:1)
Molecular Formula
C34H22Cl2CrN8O6.C2H7NO.H
Other Names and Identifiers
InChI
InChI=1S/2C17H12ClN4O3.C2H7NO.Cr/c2*1-10-15(20-19-13-8-4-2-6-11(13)17(24)25)16(23)22(21-10)14-9-5-3-7-12(14)18;3-1-2-4;/h2*2-9H,1H3,(H,24,25);4H,1-3H2;/q2*-1;;+3/p-1
InChIKey
InChIKey=WQTLWKBHNLFCFM-UHFFFAOYSA-M
SMILES
O=C1[O-][Cr+3]234([N](C=5C(C(=O)[O-]2)=CC=CC5)=N[C-]6C(=O3)N(N=C6C)C7=C(Cl)C=CC=C7)[N](C=8C1=CC=CC8)=N[C-]9C(=O4)N(N=C9C)C%10=C(Cl)C=CC=C%10.[H+].C(CO)N
Canonical SMILES
[H+].O=C1[O-][Cr+3]234(O=C5[C-](N=[N]2C=6C=CC=CC16)C(=NN5C=7C=CC=CC7Cl)C)O=C8[C-](N=[N]4C=9C=CC=CC9C(=O)[O-]3)C(=NN8C=%10C=CC=CC%10Cl)C.OCCN
Other Names for this Substance
- Chromate(1-), bis[2-[[1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]benzoato(2-)]-, hydrogen, compd. with 2-aminoethanol (1:1)
- Benzoic acid, 2-[[1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]-, chromium complex
- Ethanol, 2-amino-, bis[2-[[1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]benzoato(2-)]chromate(1-)
Deleted or Replaced CAS Registry Numbers
93919-38-1