<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">4944</id>
  <title>T3D4889</title>
  <common-name>trans-Cinnamic acid</common-name>
  <description>Cinnamic acid has the formula C6H5CHCHCOOH and is an odorless white crystalline acid, which is slightly soluble in water. It has a melting point of 133 degree centigrade and a boiling point of 300 degree centigrade.</description>
  <cas>140-10-3</cas>
  <pubchem-id>444539</pubchem-id>
  <chemical-formula>C9H8O2</chemical-formula>
  <weight>148.16</weight>
  <appearance>White powder.</appearance>
  <melting-point>133 °C</melting-point>
  <boiling-point>300°C (572°F)</boiling-point>
  <density nil="true"/>
  <solubility>0.546 mg/mL</solubility>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure></route-of-exposure>
  <target nil="true"/>
  <mechanism-of-toxicity></mechanism-of-toxicity>
  <metabolism></metabolism>
  <toxicity></toxicity>
  <lethaldose></lethaldose>
  <carcinogenicity>No indication of carcinogenicity to humans (not listed by IARC).</carcinogenicity>
  <use-source></use-source>
  <min-risk-level></min-risk-level>
  <health-effects></health-effects>
  <symptoms></symptoms>
  <treatment></treatment>
  <created-at type="dateTime">2014-09-11T05:21:00Z</created-at>
  <updated-at type="dateTime">2026-04-16T22:52:24Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia>http://en.wikipedia.org/wiki/trans-Cinnamate</wikipedia>
  <uniprot-id></uniprot-id>
  <kegg-compound-id>C00423</kegg-compound-id>
  <omim-id></omim-id>
  <chebi-id>35697</chebi-id>
  <biocyc-id>CPD-674</biocyc-id>
  <ctd-id></ctd-id>
  <stitch-id></stitch-id>
  <drugbank-id nil="true"/>
  <pdb-id>TCA</pdb-id>
  <actor-id></actor-id>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>OC(=O)\C=C\C1=CC=CC=C1</moldb-smiles>
  <moldb-formula>C9H8O2</moldb-formula>
  <moldb-inchi>InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+</moldb-inchi>
  <moldb-inchikey>WBYWAXJHAXSJNI-VOTSOKGWSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">148.1586</moldb-average-mass>
  <moldb-mono-mass type="decimal">148.0524295</moldb-mono-mass>
  <origin>Exogenous</origin>
  <state>Solid</state>
  <logp>2.13</logp>
  <hmdb-id>HMDB00930</hmdb-id>
  <chembl-id></chembl-id>
  <chemspider-id>392447</chemspider-id>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference>Zhu, Min; Shentu, Chao; Zhou, Zhong Shi.  Microwave-assisted base-free synthesis of trans-cinnamic acids using hypervalent iodonium salts.    Chinese Chemical Letters  (2007),  18(3),  272-274. </synthesis-reference>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM003845</chemdb-id>
  <dsstox-id>DTXSID5022489</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>(2E)-3-phenylprop-2-enoic acid</iupac>
</compound>
