Catalog |
ACM65405778-1 |
CAS |
65405-77-8 |
Structure | |
Synonyms |
(Z)-3-Hexenyl salicylate |
IUPAC Name |
[(Z)-Hex-3-enyl] 2-hydroxybenzoate |
Molecular Weight |
220.26 |
Molecular Formula |
C13H16O3 |
Canonical SMILES |
CCC=CCCOC(=O)C1=CC=CC=C1O |
InChI |
InChI=1S/C13H16O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h3-6,8-9,14H,2,7,10H2,1H3/b4-3- |
InChI Key |
IEPWIPZLLIOZLU-ARJAWSKDSA-N |
Boiling Point |
271 °C |
Flash Point |
>230 °F |
Purity |
98% |
Density |
1.059 g/mL at 25 °C(lit.) |
Exact Mass |
220.109944368 |
Isomeric SMILES |
CC/C=C\CCOC(=O)C1=CC=CC=C1O |
Monoisotopic Mass |
220.109944368 |
Physical State |
Liquid |
Refractive Index |
n20/D 1.521(lit.) |
Topological Polar Surface Area |
46.5 Ų |
For Research Use Only. Not for use in diagnostic or therapeutic procedures.