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Details

Stereochemistry RACEMIC
Molecular Formula 3C20H8Br4O5.2Al
Molecular Weight 1997.635
Optical Activity ( + / - )
Defined Stereocenters 0 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of D&C Red No. 21 Aluminum Lake

SMILES

[Al+3].[Al+3].OC1=C(Br)C2=C(C=C1Br)C(C3=CC(Br)=C([O-])C(Br)=C3O2)C4=C(C=CC=C4)C([O-])=O.OC5=C(Br)C6=C(C=C5Br)C(C7=CC(Br)=C([O-])C(Br)=C7O6)C8=C(C=CC=C8)C([O-])=O.OC9=C(Br)C%10=C(C=C9Br)C(C%11=CC(Br)=C([O-])C(Br)=C%11O%10)C%12=C(C=CC=C%12)C([O-])=O

InChI

InChIKey=CZCBLIIGXOOUTD-UHFFFAOYSA-H
InChI=1S/3C20H10Br4O5.2Al/c3*21-11-5-9-13(7-3-1-2-4-8(7)20(27)28)10-6-12(22)17(26)15(24)19(10)29-18(9)14(23)16(11)25;;/h3*1-6,13,25-26H,(H,27,28);;/q;;;2*+3/p-6

HIDE SMILES / InChI

Molecular Formula C20H8Br4O5
Molecular Weight 647.891
Charge -2
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula Al
Molecular Weight 26.9815386
Charge 3
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 21:13:33 GMT 2025
Edited
by admin
on Wed Apr 02 21:13:33 GMT 2025
Record UNII
2M7H5Y5MJP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Red 21 Lake
INCI  
Preferred Name English
Pigment Red 90:1 Aluminum Lake
INCI  
Preferred Name English
D&C Red No. 21 Aluminum Lake
FDA  
Official Name English
C.I. PIGMENT RED 90 ALUMINUM SALT
Common Name English
2?,4?,5?,7?-Tetrabromofluorescein aluminum salt
Common Name English
CI 45380:3
Common Name English
EOSINE, ALUMINUM SALT
Common Name English
RED 230 ALUMINUM LAKE
Common Name English
D&C RED 21 ALUMINUM LAKE
Common Name English
D&C RED NO. 21--ALUMINUM LAKE
II  
Common Name English
Aluminum, tris[2?,4?,5?,7?-tetrabromofluoresceinato(2-)]di-
Systematic Name English
Spiro[isobenzofuran-1(3H),9?-[9H]xanthen]-3-one, 2?,4?,5?,7?-tetrabromo-3?,6?-dihydroxy-, aluminum salt (3:2)
Systematic Name English
Fluorescein, 2?,4?,5?,7?-tetrabromo-, aluminum salt
Common Name English
C.I. 45380:3
Common Name English
C.I. PIGMENT RED 90:1
Common Name English
Dialuminum tris[2-(2,4,5,7-tetrabromo-6-oxido-3-oxoxanthen-9-yl)benzoate]
Systematic Name English
JAPAN RED 230 ALUMINUM LAKE
Common Name English
PIGMENT RED 90:1
Common Name English
DC RED NO. 21-ALUMINUM LAKE
Common Name English
DYE DC RED NO. 21 ALUMINIUM LAKE
Common Name English
Code System Code Type Description
CAS
15876-39-8
Created by admin on Wed Apr 02 21:13:33 GMT 2025 , Edited by admin on Wed Apr 02 21:13:33 GMT 2025
PRIMARY
ECHA (EC/EINECS)
240-569-4
Created by admin on Wed Apr 02 21:13:33 GMT 2025 , Edited by admin on Wed Apr 02 21:13:33 GMT 2025
ALTERNATIVE
EPA CompTox
DTXSID60879810
Created by admin on Wed Apr 02 21:13:33 GMT 2025 , Edited by admin on Wed Apr 02 21:13:33 GMT 2025
PRIMARY
ECHA (EC/EINECS)
240-005-7
Created by admin on Wed Apr 02 21:13:33 GMT 2025 , Edited by admin on Wed Apr 02 21:13:33 GMT 2025
ALTERNATIVE
CAS
16508-80-8
Created by admin on Wed Apr 02 21:13:33 GMT 2025 , Edited by admin on Wed Apr 02 21:13:33 GMT 2025
NON-SPECIFIC STOICHIOMETRY
FDA UNII
2M7H5Y5MJP
Created by admin on Wed Apr 02 21:13:33 GMT 2025 , Edited by admin on Wed Apr 02 21:13:33 GMT 2025
PRIMARY
PUBCHEM
171390272
Created by admin on Wed Apr 02 21:13:33 GMT 2025 , Edited by admin on Wed Apr 02 21:13:33 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE