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Thermo Scientific™ Chlorogenic acid, 98%, predominantly trans, from coffee seeds

Catalog No. AC109240050
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Glass bottle; 5g
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Catalog No.
AC109240050 Glass bottle; 5g
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Catalog No. AC109240050 Supplier Thermo Scientific™ Supplier No. 109240050

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Please call Customer Service at 1-800-234-7437 or send an email to help@thermofisher.com for assistance.

This Thermo Scientific brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific.

Specifications

CAS 327-97-9
Infrared Spectrum Authentic
Assay Percent Range 97.5% min. (HPLC)
Packaging Glass bottle
Molecular Formula C16H18O9
Quantity 5g
MDL Number MFCD00003862
Beilstein 10, I, 271
Merck Index 15, 2143
Specific Rotation -36
Synonym chlorogenic acid, 3-caffeoylquinic acid, chlorogenate, 3-o-caffeoylquinic acid, 3-3,4-dihydroxycinnamoyl quinic acid, heriguard, hlorogenic acid, caffeoyl quinic acid, 3-caffeoylquinate, unii-318adp12ri
Solubility Information Solubility in water: soluble in hot water. Other solubilities: soluble in alcohol and acetone
InChI Key CWVRJTMFETXNAD-JUHZACGLSA-N
SMILES O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\C2=CC=C(O)C(O)=C2)[C@@H]1O)C(O)=O
IUPAC Name (1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid
Molecular Weight (g/mol) 354.31
PubChem CID 1794427
ChEBI CHEBI:16112
Formula Weight 354.3
Percent Purity 98%
Chemical Name or Material Chlorogenic acid, Predominantly trans, From coffee seeds
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EINECSNumber 206-325-6

RUO – Research Use Only