CAS |
24851-98-7 |
Structure | |
Synonyms |
Hedione |
IUPAC Name |
Methyl 2-(3-oxo-2-pentylcyclopentyl)acetate |
Molecular Weight |
226.31 |
Canonical SMILES |
CCCCCC1C(CCC1=O)CC(=O)OC |
InChI |
InChI=1S/C13H22O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h10-11H,3-9H2,1-2H3 |
InChI Key |
KVWWIYGFBYDJQC-UHFFFAOYSA-N |
Boiling Point |
110 °C |
Melting Point |
-10 °C |
Flash Point |
>230 °F |
Purity |
95%+ |
Density |
0.998 g/mL at 25 °C(lit.) |
Exact Mass |
226.15689456 |
Monoisotopic Mass |
226.15689456 |
Physical State |
Liquid |
Refractive Index |
n20/D 1.459(lit.) |
Storage Conditions |
2-8 °C |
Topological Polar Surface Area |
43.4 Ų |
For Research Use Only. Not for use in diagnostic or therapeutic procedures.