Isoferulic acid information

Isoferulic acid
Names
	IUPAC name (E)-3-(3-Hydroxy-4-methoxyphenyl)prop-2-enoic acid
	Other names Hesperetic acid; 3-(3-Hydroxy-4-methoxyphenyl)acrylic acid; Hesperetate; Isoferulate
Identifiers
CAS Number	537-73-5 ;
3D model (JSmol)	Interactive image;
ChEBI	CHEBI:27794;
ChemSpider	643318;
ECHA InfoCard	100.007.889
PubChem CID	736186;
UNII	XSQ2K2G7MC ;
CompTox Dashboard (EPA)	DTXSID501009309 ;
	InChI InChI=1S/C10H10O4/c1-14-9-4-2-7(6-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+ Key: QURCVMIEKCOAJU-HWKANZROSA-N;
	SMILES COC1=C(C=C(C=C1)C=CC(=O)O)O;
Properties
Chemical formula	C10H10O4
Molar mass	194.186 g·mol−1
	Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). Infobox references

Isoferulic acid is a hydroxycinnamic acid, a type of organic compound. It is an isomer of ferulic acid.

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Names

IUPAC name (E)-3-(3-Hydroxy-4-methoxyphenyl)prop-2-enoic acid
Other names Hesperetic acid 3-(3-Hydroxy-4-methoxyphenyl)acrylic acid Hesperetate Isoferulate
Identifiers
CAS Number	537-73-5^Y
3D model (JSmol)	Interactive image
ChEBI	CHEBI:27794
ChemSpider	643318
ECHA InfoCard	100.007.889
PubChem CID	736186
UNII	XSQ2K2G7MC^Y
CompTox Dashboard (EPA)	DTXSID501009309
InChI InChI=1S/C10H10O4/c1-14-9-4-2-7(6-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+ Key: QURCVMIEKCOAJU-HWKANZROSA-N
SMILES COC1=C(C=C(C=C1)C=CC(=O)O)O
Properties
Chemical formula	C₁₀H₁₀O₄
Molar mass	194.186 g·mol⁻¹
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). Infobox references