Methyl (9Z,11S)-11-hydroxy-11-[(2R,3R)-3-pentyl-2-oxiranyl]-9-undecenoate
[CAS# 88199-82-0]

Identification

• Name: Methyl (9Z,11S)-11-hydroxy-11-[(2R,3R)-3-pentyl-2-oxiranyl]-9-undecenoate
• Synonyms: 9-Undecenoic acid, 11-hydroxy-11-(3-pentyloxiranyl)-, methyl ester, (2α(9Z,11S*),3β)-; Methyl (2α(9Z,11S*),3β)-11-hydroxy-11-(3-pentyloxiranyl)-9-undecenoate; Methyl 11-hydroxy-11-(3-pentyloxiranyl)-9-undecenoate (2α(9Z,11S*),3β)-
• Molecular Formula: C₁₉H₃₄O₄
• Molecular Weight: 326.47
• CAS Registry Number: 88199-82-0
• SMILES: O=C(OC)CCCCCCC/C=C\[C@H](O)[C@H]1O[C@@H]1CCCCC
• InChI: 1S/C19H34O4/c1-3-4-10-14-17-19(23-17)16(20)13-11-8-6-5-7-9-12-15-18(21)22-2/h11,13,16-17,19-20H,3-10,12,14-15H2,1-2H3/b13-11-/t16-,17+,19+/m0/s1
• InChIKey: KUCGUAVQKWTIDU-OEWRHQHNSA-N

Properties

• Density: 0.999g/cm³ (Cal.)
• Boiling point: 431.207°C at 760 mmHg (Cal.)
• Flash point: 141.264°C (Cal.)