Methyl erucate

1120-34-9

CAS Name

Methyl erucate

Molecular Formula

C₂₃H₄₄O₂

Molecular Mass

352.59

Compound Properties

• Boiling Point (1)

  221-222 °C @ Press: 5 Torr

• Melting Point (2)

  -1.16-1.20 °C

• Density (1)

  0.8702 g/cm³ @ Temp: 20 °C

Source(s)

• (1) Toyama, Yoshiyuki; J. Chem. Ind. Japan, (1922), 25, 1053-5, CAplus
• (2) Jantzen, Ernst; Chemische Berichte, (1959), 92, 1427-37, CAplus

Other Names and Identifiers

InChI

InChI=1S/C23H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h10-11H,3-9,12-22H2,1-2H3/b11-10-

InChIKey

InChIKey=ZYNDJIBBPLNPOW-KHPPLWFESA-N

SMILES

C(CCCCCC/C=C\CCCCCCCC)CCCCC(OC)=O

Canonical SMILES

O=C(OC)CCCCCCCCCCCC=CCCCCCCCC

Other Names for this Substance