7-oxodehydroabietic acid

Chemical Properties

Melting point	90-91 °C
Boiling point	475.4±45.0 °C(Predicted)
Density	1.122±0.06 g/cm3(Predicted)
storage temp.	Store at -20°C
pka	4.52±0.40(Predicted)
form	Solid
color	White to off-white
InChI	InChI=1S/C20H26O3/c1-12(2)13-6-7-15-14(10-13)16(21)11-17-19(15,3)8-5-9-20(17,4)18(22)23/h6-7,10,12,17H,5,8-9,11H2,1-4H3,(H,22,23)/t17-,19-,20-/m1/s1
InChIKey	MSWJSDLNPCSSNW-MISYRCLQSA-N
SMILES	[C@@]1(C)(C(O)=O)[C@@]2([H])[C@@](C)(C3=C(C(=O)C2)C=C(C(C)C)C=C3)CCC1
EPA Substance Registry System	1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-9-oxo-, (1R,4aS,10aR)- (18684-55-4)

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