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2-Mercaptoethyl (9Z,12Z)-Octadeca-9,12-Dienoate
[CAS# 52147-29-2]

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Identification
Name 2-Mercaptoethyl (9Z,12Z)-Octadeca-9,12-Dienoate
Synonyms (9Z,12Z)-Octadeca-9,12-Dienoic Acid 2-Mercaptoethyl Ester; 9,12-Octadecadienoic Acid (Z,Z)-, 2-Mercaptoethyl Ester
Molecular Structure CAS#: 52147-29-2, 2-Mercaptoethyl (9Z,12Z)-Octadeca-9,12-Dienoate
Molecular Formula C20H36O2S
Molecular Weight 340.56
CAS Registry Number 52147-29-2
EINECS 257-690-3
SMILES C(OC(CCCCCCC\C=C/C/C=C\CCCCC)=O)CS
InChI 1S/C20H36O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(21)22-18-19-23/h6-7,9-10,23H,2-5,8,11-19H2,1H3/b7-6-,10-9-
InChIKey OVTHRUQOYWQEJA-HZJYTTRNSA-N
Properties
Density 0.937g/cm3 (Cal.)
Boiling point 437.235°C at 760 mmHg (Cal.)
Flash point 283.75°C (Cal.)
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