Artemisic acid
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Artemisic acid

CAS 80286-58-4
Structure
Synonyms 4,11(13)-Cadinadien-12-oic acid
IUPAC Name 2-[(1R,4R,4aS,8aR)-4,7-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]prop-2-enoic acid
Molecular Weight 234.33
Molecular Formula C15H22O2
Canonical SMILES C[C@@H]1CC[C@H]([C@@H]2[C@H]1CCC(=C2)C)C(=C)C(=O)O
InChI InChI=1S/C15H22O2/c1-9-4-6-12-10(2)5-7-13(14(12)8-9)11(3)15(16)17/h8,10,12-14H,3-7H2,1-2H3,(H,16,17)/t10-,12+,13+,14+/m1/s1
InChI Key PLQMEXSCSAIXGB-SAXRGWBVSA-N
Boiling Point 373.6±11.0 °C
Melting Point 129-131 °C
Purity 98%
Density 1.019 g/ml
pKa 4.32±0.11
Appearance Powder

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