2,3,4-Trimethoxycinnamic acid - 33130-03-9

2,3,4-Trimethoxycinnamic acid

Catalog Number: EVT-293564
CAS Number: 33130-03-9
Molecular Formula: C12H14O5
Molecular Weight: 238.24 g/mol
The product is for non-human research only. Not for therapeutic or veterinary use.

Product Introduction

Description
2,3,4-Trimethoxycinnamic Acid is a chemical compound with the molecular formula C12H14O5 . It has an average mass of 238.237 Da and a monoisotopic mass of 238.084122 Da .

Molecular Structure Analysis

The molecular structure of 2,3,4-Trimethoxycinnamic acid consists of a cinnamic acid core with three methoxy groups attached at the 2, 3, and 4 positions . The compound has a double bond in the trans configuration .

Physical And Chemical Properties Analysis

2,3,4-Trimethoxycinnamic Acid has a density of 1.2±0.1 g/cm3, a boiling point of 392.2±37.0 °C at 760 mmHg, and a flash point of 149.7±20.0 °C . It has a molar refractivity of 63.7±0.3 cm3, a polar surface area of 65 Å2, and a molar volume of 197.0±3.0 cm3 .

Properties

CAS Number

33130-03-9

Product Name

2,3,4-Trimethoxycinnamic acid

IUPAC Name

(E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoic acid

Molecular Formula

C12H14O5

Molecular Weight

238.24 g/mol

InChI

InChI=1S/C12H14O5/c1-15-9-6-4-8(5-7-10(13)14)11(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b7-5+

InChI Key

ZYOPDNLIHHFGEC-FNORWQNLSA-N

SMILES

COC1=C(C(=C(C=C1)C=CC(=O)O)OC)OC

Synonyms

(Z)-3-(2,3,4-trimethoxyphenyl)acrylic acid
3-(2,3,4-trimethoxyphenyl)acrylic acid

Canonical SMILES

COC1=C(C(=C(C=C1)C=CC(=O)O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)/C=C/C(=O)O)OC)OC

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