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Catalog | BBC200813316 |
CAS | 200813-31-6 |
Synonyms | 16-Nor-15-oxodehydroabietic acid |
IUPAC Name | 7-Acetyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid |
Molecular Weight | 300.39 |
Molecular Formula | C19H24O3 |
Canonical SMILES | CC(=O)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C(=O)O)C |
InChI | InChI=1S/C19H24O3/c1-12(20)13-5-7-15-14(11-13)6-8-16-18(15,2)9-4-10-19(16,3)17(21)22/h5,7,11,16H,4,6,8-10H2,1-3H3,(H,21,22) |
InChI Key | VUSNLFYUMKLEAV-UHFFFAOYSA-N |
Boiling Point | 470.4±45.0 °C |
Purity | 98% |
Density | 1.132±0.06 g/ml |
Appearance | Solid |
pKa | 4.62±0.40 |
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