Herbarin

Datasheet MSDS
Catalog Number
ANC04376
Product Name
Herbarin
CAS Number
36379-67-6
IUPAC Name
3-hydroxy-7,9-dimethoxy-3-methyl-1,4-dihydrobenzo[g]isochromene-5,10-dione
Synonyms
dehydroherbarin; Ambotz; 1H-Naphtho(2,3-c)pyran-5,10-dione,3,4-dihydro-3-hydroxy-7,9-dimethoxy-3-methyl-; 3-Hydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-naphtho[2,3-c]pyran-5,10-dione
Molecular Formula
C16H16O6
Molecular Weight
304.3
Appearance
Yellow Acicular Crystal
Purity
97%
Density
1.39g/cm3
Solubility
Soluble in Ethyl Acetate; Insoluble in Water
Melting Point
192-193°C
Boiling Point
548.5°C@760mmHg
SMILES
CC1(CC2=C(CO1)C(=O)C3=C(C2=O)C=C(C=C3OC)OC)O
InChI
InChI=1S/C16H16O6/c1-16(19)6-10-11(7-22-16)15(18)13-9(14(10)17)4-8(20-2)5-12(13)21-3/h4-5,19H,6-7H2,1-3H3
InChI Key
MQWLANHTCHDMAR-UHFFFAOYSA-N
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