00500590

Chlorogenic acid

primary reference standard

• Synonym(s): 1,4,5-Trihydroxycyclohexanecarboxylic acid 3-(3,4-dihydroxycinnamate), 3-(3,4-Dihydroxycinnamoyl)quinic acid
• Empirical Formula (Hill Notation): C₁₆H₁₈O₉
• CAS Number: 327-97-9
• Molecular Weight: 354.31
• EC Number: 206-325-6
• MDL number: MFCD00003862
• PubChem Substance ID: 329747087
• NACRES: NA.24

Properties

• grade: primary reference standard
• shelf life: limited shelf life, expiry date on the label
• manufacturer/tradename: HWI
• technique(s): HPLC: suitable; gas chromatography (GC): suitable
• mp: 210 °C (dec.) (lit.)
• SMILES string: O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)C(O)=O
• InChI: 1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1
• InChI key: CWVRJTMFETXNAD-JUHZACGLSA-N

Description

General description

Produced and qualified by HWI pharma services GmbH.
Exact content by quantitative NMR can be found on the certificate.

Application

Reference standard in the analysis of herbal medicinal products

Safety Information

• Storage Class Code: 13 - Non Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable