6730-83-2

Name kaurenoic acid
CAS 6730-83-2
Molecular Formula C20H30O2
MDL Number MFCD28978039
Molecular Weight 302.45
MOL File 6730-83-2.mol

Chemical Properties

Melting point  171-172 °C
Boiling point  426.6±34.0 °C(Predicted)
density  1.10±0.1 g/cm3(Predicted)
storage temp.  Sealed in dry,Store in freezer, under -20°C
solubility  DMF: 10 mg/ml; DMSO: 25 mg/ml; DMSO:PBS (pH 7.2) (1:2): 0.3 mg/ml; Ethanol: 10 mg/ml
form  A solid
pka 4.70±0.40(Predicted)
color  White to off-white
Major Application metabolomics
vitamins, nutraceuticals, and natural products
InChI 1S/C20H30O2/c1-13-11-20-10-7-15-18(2,16(20)6-5-14(13)12-20)8-4-9-19(15,3)17(21)22/h14-16H,1,4-12H2,2-3H3,(H,21,22)/t14-,15+,16+,18-,19-,20-/m1/s1
InChIKey NIKHGUQULKYIGE-OTCXFQBHSA-N
SMILES C=C1C[C@@]23CC[C@]4([H])[C@@](C(O)=O)(C)CCC[C@@]4(C)[C@]2([H])CC[C@@H]1C3

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

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