CAS |
7780-06-5 |
Structure | |
Synonyms |
2-Propenoic acid, 3-phenyl-, 1-methylethyl ester |
IUPAC Name |
Propan-2-yl (E)-3-phenylprop-2-enoate |
Molecular Weight |
190.24 |
Canonical SMILES |
CC(C)OC(=O)C=CC1=CC=CC=C1 |
InChI |
InChI=1S/C12H14O2/c1-10(2)14-12(13)9-8-11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8+ |
InChI Key |
RGACABDFLVLVCT-CMDGGOBGSA-N |
Boiling Point |
273 °C |
Melting Point |
39 °C |
Flash Point |
>230 °F |
Purity |
98%+ |
Density |
1.02 g/mL at 25 °C(lit.) |
Solubility |
Insoluble in water; soluble in oils |
Exact Mass |
190.099379685 |
Isomeric SMILES |
CC(C)OC(=O)/C=C/C1=CC=CC=C1 |
Monoisotopic Mass |
190.099379685 |
Physical State |
Liquid |
Refractive Index |
n20/D 1.546(lit.) |
Topological Polar Surface Area |
26.3 Ų |
For Research Use Only. Not for use in diagnostic or therapeutic procedures.