Citronellyl tiglate

• CAS: 24717-85-9
• Catalog Number: ACM24717859
• Category: Other Products
• Molecular Weight: 238.37
• Molecular Formula: C15H26O2
• Synonyms: Citronellyl trans-2-methyl-2-butenoate
• IUPAC Name: 3,7-Dimethyloct-6-enyl (E)-2-methylbut-2-enoate
• Canonical SMILES: CC=C(C)C(=O)OCCC(C)CCC=C(C)C
• InChI: InChI=1S/C15H26O2/c1-6-14(5)15(16)17-11-10-13(4)9-7-8-12(2)3/h6,8,13H,7,9-11H2,1-5H3/b14-6+
• InChI Key: UCFQYMKLDPWFHZ-MKMNVTDBSA-N
• Boiling Point: 144-145 °C
• Flash Point: >230 °F
• Density: 0.903 g/mL at 25 °C(lit.)
• Solubility: Practically insoluble to insoluble in water
• Appearance: Colorless clear liquid (est)
• Assay: 0.98
• EC Number: 246-426-2
• Exact Mass: 238.193280068
• Isomeric SMILES: C/C=C(\C)/C(=O)OCCC(C)CCC=C(C)C
• MDL Number: MFCD00036577
• Monoisotopic Mass: 238.193280068
• Odor: Winey rosy aroma
• Packaging: 1 kg
• Physical State: Liquid
• Refractive Index: n20/D 1.465(lit.)
• Topological Polar Surface Area: 26.3 Ų