73543-67-6

Name 9(S)-HODE
CAS 73543-67-6
EINECS(EC#) 804-144-2
Molecular Formula C18H32O3
MDL Number MFCD00065831
Molecular Weight 296.44
MOL File 73543-67-6.mol
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Chemical Properties

Boiling point  416.1±33.0 °C(Predicted)
density  0.970±0.06 g/cm3(Predicted)
Fp  14℃
storage temp.  -20°C
solubility  DMF: 50 mg/ml; DMSO: 50 mg/ml; Ethanol: 50 mg/ml; PBS pH 7.2: 1 mg/ml
form  ethanol solution (1 mg/mL)
pka 4.78±0.10(Predicted)
color  colorless to light yellow
InChI 1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+/t17-/m1/s1
InChIKey NPDSHTNEKLQQIJ-UINYOVNOSA-N
SMILES CCCCC/C=C\C=C\[C@@H](O)CCCCCCCC(O)=O

Safety Data

Hazard Codes  F
Risk Statements 
Safety Statements 
RIDADR  UN1170 - class 3 - PG 2 - Ethanol, solution
WGK Germany  1
Storage Class 3 - Flammable liquids
Hazard Classifications Eye Irrit. 2
Flam. Liq. 2

Hazard Information

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