29623-28-7

Name 13(S)-HYDROXYOCTADECA-9Z,11E-DIENOIC ACID
CAS 29623-28-7
EINECS(EC#) 200-578-6
Molecular Formula C18H32O3
MDL Number MFCD00065833
Molecular Weight 296.44
MOL File 29623-28-7.mol
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Chemical Properties

Boiling point  422.7±20.0 °C(Predicted)
density  0.970±0.06 g/cm3(Predicted)
Fp  14 °C
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  Clear to light-yellow liquid.
pka 4.78±0.10(Predicted)
color  Colorless to light yellow
InChI 1S/C18H32O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7-,15-12+/t17-/m0/s1
InChIKey HNICUWMFWZBIFP-IRQZEAMPSA-N
SMILES CCCCC[C@H](O)\C=C\C=C/CCCCCCCC(O)=O

Safety Data

Hazard Codes  F
Risk Statements 
Safety Statements 
RIDADR  UN 1170 3/PG 2
WGK Germany  3
HazardClass  3
Storage Class 3 - Flammable liquids
Hazard Classifications Eye Irrit. 2
Flam. Liq. 2

Hazard Information

Spectrum Detail

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