5835-26-7

Name ISOPIMARIC ACID
CAS 5835-26-7
EINECS(EC#) 200-258-5
Molecular Formula C20H30O2
MDL Number MFCD04113116
Molecular Weight 302.45
MOL File 5835-26-7.mol

Chemical Properties

Melting point  160°
alpha  D16 -3.6° (10.4% soln in 1:1 alcohol:chloroform)
Boiling point  383.47°C (rough estimate)
density  1.0434 (rough estimate)
refractive index  1.4980 (estimate)
storage temp.  -20°C
solubility  DMSO: ~26 mg/mL
form  solid
pka 4?+-.0.60(Predicted)
color  white
Stability: Stable for 1 year as supplied. Solutions in DMSO may be stored at -20°C for up to 3 months.
InChI InChI=1S/C20H30O2/c1-5-18(2)12-9-15-14(13-18)7-8-16-19(15,3)10-6-11-20(16,4)17(21)22/h5,7,15-16H,1,6,8-13H2,2-4H3,(H,21,22)/t15-,16+,18-,19+,20+/m0/s1
InChIKey MXYATHGRPJZBNA-KRFUXDQASA-N
SMILES [C@@]1(C)(C(O)=O)[C@@]2([H])[C@@](C)([C@]3([H])C(=CC2)C[C@](C=C)(C)CC3)CCC1
EPA Substance Registry System Isopimaric acid (5835-26-7)

Safety Data

RIDADR  UN 3077 9 / PGIII
WGK Germany  3

Hazard Information

Supplier