(3S,4S)-3-Hexyl-4-((R)-2-hydroxytridecyl)oxetan-2-one

104872-06-2

CAS Name

(3S,4S)-3-Hexyl-4-[(2R)-2-hydroxytridecyl]-2-oxetanone

Molecular Formula

C₂₂H₄₂O₃

Molecular Mass

354.57

Compound Properties

• Melting Point (1)

  61-62 °C

Source(s)

• (1) Yadav, J. S.; Synthesis, (2006), (22), 3888-3894, CAplus

Other Names and Identifiers

InChI

InChI=1S/C22H42O3/c1-3-5-7-9-10-11-12-13-14-16-19(23)18-21-20(22(24)25-21)17-15-8-6-4-2/h19-21,23H,3-18H2,1-2H3/t19-,20+,21+/m1/s1

InChIKey

InChIKey=RSOUWOFYULUWNE-HKBOAZHASA-N

SMILES

C([C@@H](CCCCCCCCCCC)O)[C@H]1[C@H](CCCCCC)C(=O)O1

Canonical SMILES

O=C1OC(CC(O)CCCCCCCCCCC)C1CCCCCC

Other Names for this Substance