Ximenynic acid[西门木林酸]

557-58-4

CAS Name

Ximenynic acid

Molecular Formula

C₁₈H₃₀O₂

Molecular Mass

278.43

Compound Properties

• Melting Point (1)

  40-41 °C

Source(s)

• (1) Lighthelm, S. P.; Journal of the American Chemical Society, (1950), 72, 1868, CAplus

Other Names and Identifiers

InChI

InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h7-8H,2-6,11-17H2,1H3,(H,19,20)/b8-7+

InChIKey

InChIKey=VENIIVIRETXKSV-BQYQJAHWSA-N

SMILES

C(CC#C/C=C/CCCCCC)CCCCCC(O)=O

Canonical SMILES

O=C(O)CCCCCCCC#CC=CCCCCCC

Other Names for this Substance