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Product Overview

Product Code

CDX-00006301

CAS Number

489-50-9

Product Format

Neat

Molecular Formula

C22 H16 O12

Molecular Weight

472.355

Product Categories

Coumarins

Documentation

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Product Information

Analyte Data

Analyte Name

Fumarprotocetraric Acid

CAS Number

489-50-9

Molecular Formula

C22 H16 O12

Molecular Weight

472.355

Accurate Mass

472.064

Melting Point

252-260

Appearance/Form

Powder

Color

White

Odor

Odourless

SMILES

Cc1cc(O)c(C=O)c2Oc3c(C)c(C(=O)O)c(O)c(COC(=O)\C=C\C(=O)O)c3OC(=O)c12

InChI

InChI=1S/C22H16O12/c1-8-5-12(24)10(6-23)19-15(8)22(31)34-20-11(7-32-14(27)4-3-13(25)26)17(28)16(21(29)30)9(2)18(20)33-19/h3-6,24,28H,7H2,1-2H3,(H,25,26)(H,29,30)/b4-3+

IUPAC

4-[[(E)-3-carboxyprop-2-enoyl]oxymethyl]-10-formyl-3,9-dihydroxy-1,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylic acid

Product Data

Storage Temperature

Room Temperature

Shipping Temperature

Room Temperature

Country of Origin

UNITED STATES

Tariff Code

29329900

Product Format

Neat

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