28282-25-9

Name BETA-ELEMONIC ACID
CAS 28282-25-9
EINECS(EC#) 300-005-5
Molecular Formula C30H46O3
MDL Number MFCD00467083
Molecular Weight 454.68
MOL File 28282-25-9.mol
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Chemical Properties

Melting point  224-225°C
Boiling point  565.2±50.0 °C(Predicted)
density  1.07
storage temp.  2-8°C
solubility  DMF: 30 mg/ml; DMF:PBS (pH 7.2)(1:3): 0.25 mg/ml; DMSO: 5 mg/ml; Ethanol: 5 mg/ml
form  A crystalline solid
pka 4.65±0.10(Predicted)
color  White to off-white
InChIKey XLPAINGDLCDYQV-XUWOXAENSA-N
SMILES C\C(C)=C\CC[C@@H]([C@@H]1CC[C@]2(C)C3=C(CC[C@@]12C)[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC3)C(O)=O

Safety Data

WGK Germany  WGK 3
Storage Class 13 - Non Combustible Solids

Hazard Information

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