82209-74-3

Name 19-HYDROXY-8(17),13-LABDADIEN-16,15-OLIDE
CAS 82209-74-3
Molecular Formula C20H30O3
MDL Number MFCD07778568
Molecular Weight 318.45
MOL File 82209-74-3.mol
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Chemical Properties

Melting point  106-107℃
Boiling point  468.7±18.0 °C(Predicted)
density  1.09
storage temp.  4°C, protect from light
solubility  DMSO : 100 mg/mL (314.02 mM; ultrasonic and warming and heat to 60°C)
form  neat
pka 14.96±0.10(Predicted)
color  White to off-white
InChI 1S/C20H30O3/c1-14-5-8-17-19(2,13-21)10-4-11-20(17,3)16(14)7-6-15-9-12-23-18(15)22/h9,16-17,21H,1,4-8,10-13H2,2-3H3/t16-,17-,19+,20+/m1/s1
InChIKey WKKBRRFSRMDTJB-JYBIWHBTSA-N
SMILES C[C@@]1(CO)CCC[C@@]2(C)[C@H](CCC3=CCOC3=O)C(=C)CC[C@H]12

Safety Data

WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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