Carmine

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Catalog Number ACM1390654-1
Product Name Carmine
CAS Number 1390-65-4
Structure Carmine
IUPAC Name 3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-2-carboxylic acid
Synonyms Alum Lake Of Carminic Acid
Molecular Weight 492.39
Molecular Formula C22H20O13
Canonical SMILES CC1=C2C(=CC(=C1C(=O)O)O)C(=O)C3=C(C2=O)C(=C(C(=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O
Inchi InChI=1S/C22H20O13/c1-4-8-5(2-6(24)9(4)22(33)34)13(25)10-11(15(8)27)16(28)12(18(30)17(10)29)21-20(32)19(31)14(26)7(3-23)35-21/h2,7,14,19-21,23-24,26,28-32H,3H2,1H3,(H,33,34)
InChIKey DGQLVPJVXFOQEV-UHFFFAOYSA-N
Boiling Point 907.60 °C at 760 mmHg (Predicted)
Melting Point 136 ºC dec
Flash Point 316.1±27.8 °C
Purity 40%
Density 1.9±0.1 g/cm3
Appearance Powder
Refractive Index 1.79 (Predicted)

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