Details of the Drug Excipient
General Information of Drug Inactive Ingredient (DIG) (ID: E00610)
DIG Name |
D&C red no. 6 barium lake
|
||||
---|---|---|---|---|---|
Synonyms |
D&C Red No. 6 barium lake; UNII-K4XZD9W99K; 17852-98-1; K4XZD9W99K; 2-Naphthalenecarboxylic acid, 3-hydroxy-4-(2-(4-methyl-2-sulfophenyl)diazenyl)-, barium salt (1:1); 2-Naphthalenecarboxylic acid, 3-hydroxy-4-[2-(4-methyl-2-sulfophenyl)diazenyl]-, barium salt (1:1); D And C Red No. 6, barium lake; C.I. Pigment Red 57, barium salt (1:1); EINECS 241-806-4; SCHEMBL9107772; DTXSID30884991; 2-Naphthalenecarboxylic acid, 3-hydroxy-4-((4-methyl-2-sulfophenyl)azo)-, barium salt (1:1); Q27281965; Barium 3-hydroxy-4-((4-methyl-2-sulphonatophenyl)azo)-2-naphthoate; Barium 3-hydroxy-4-[(4-methyl-2-sulfonatophenyl)azo]-2-naphthoate
|
||||
DIG Function |
Colorant
|
||||
Formula |
C18H12BaN2O6S
|
||||
Canonical SMILES |
CC1=CC(=C(C=C1)N=NC2=C(C(=CC3=CC=CC=C32)C(=O)O)[O-])S(=O)(=O)[O-].[Ba+2]
|
||||
InChI |
1S/C18H14N2O6S.Ba/c1-10-6-7-14(15(8-10)27(24,25)26)19-20-16-12-5-3-2-4-11(12)9-13(17(16)21)18(22)23;/h2-9,21H,1H3,(H,22,23)(H,24,25,26);/q;+2/p-2
|
||||
InChIKey |
GSEGKBMSKPDICA-UHFFFAOYSA-L
|
||||
Physicochemical Properties | Molecular Weight | 521.7 | Topological Polar Surface Area | 151 | |
XlogP | N.A. | Complexity | 663 | ||
Heavy Atom Count | 28 | Rotatable Bond Count | 3 | ||
Hydrogen Bond Donor Count | 1 | Hydrogen Bond Acceptor Count | 8 | ||