Specification
Synonyms
2,4,5-Trimethoxy-trans-cinnamic acid
IUPAC Name
(E)-3-(2,4,5-Trimethoxyphenyl)prop-2-enoic acid
Canonical SMILES
COC1=CC(=C(C=C1C=CC(=O)O)OC)OC
InChI
InChI=1S/C12H14O5/c1-15-9-7-11(17-3)10(16-2)6-8(9)4-5-12(13)14/h4-7H,1-3H3,(H,13,14)/b5-4+
InChI Key
XCEGAEUDHJEYRY-SNAWJCMRSA-N
Density
1.1416 g/mL at 25 °C(lit.)
Isomeric SMILES
COC1=CC(=C(C=C1C=CC(=O)O)OC)OC
Monoisotopic Mass
238.08412354
Refractive Index
n20/D 1.4571(lit.)
Storage Conditions
Dry place,Room Temperature
Topological Polar Surface Area
65 Ų