Chicoric acid | CAS No. 6537-80-0

Chicoric acid

Basic Information

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CAS Number

6537-80-0

Molecular Formula

C22H18O12

Molecular Weight

474.37 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

785°C at 760 mmHg

Density

1.6±0.1 g/cm3

Flash Point

272.9±26.4 °C

Solubility

25.62 mg/L @ 25 °C (est)

SMILES

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C1=CC(=C(C=C1C=CC(=O)OC(C(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)C(=O)O)O)O

InChI

InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/b7-3+,8-4+/t19-,20-/m1/s1

InChIKey

YDDGKXBLOXEEMN-IABMMNSOSA-N

LogP

1.2283999999999995

Topological Polar Surface Area

208.11999999999998 Å²

Hydrogen Bond Donor/Acceptor

6 / 12

Complexity

740

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H317 May cause an allergic skin reaction
Sensitization, Skin

H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled
Sensitization, respiratory

Storage Conditions

-20℃

Synonyms & References

English

NCGC00091914-04
CCG-269487
Butanedioic acid, 2,3-bis[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-, (2R,3R)- (9CI)
(2R,3R)-2,3-Bis[[(E)-3-(3,4-dihydroxyphenyl)acryloyl]oxy]succinic Acid
CHEBI:3594
(-)-Chicoric acid;trans-Caffeoyltartaric acid
GKP
(2R,3R)-2,3-bis((E)-3-(3,4-dihydroxyphenyl)acryloyloxy)succinic acid
UNII-S4YY3V8YHD
Chicoric acid
Chicoric acid, (-)-
s9133
Chicoric Acid, United States Pharmacopeia (USP) Reference Standard
Butanedioic acid, 2,3-bis((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-, (R-(R*,R*))-
Butanedioic acid, 2,3-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-, [R-[R*,R*-(E,E)]]-
70831-56-0
Butanedioic acid, 2,3-bis((3-(3,4-dihydroxphenyl)-1-oxo-2-propenyl)oxy)-, (R-(R*,R*-(E,E)))-
DTXSID0033332
NCGC00091914-04!(2R,3R)-2,3-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]butanedioic acid
NSC699173
NS00037116
Tox21_201055
Q5119402
C3450
HY-N0457
DTXCID8013332
SCHEMBL15532218
Dicaffeoyl-L-tartaric acid
L-Chicoricacid
BDBM50076273
CHEMBL282731

MDL Number

MFCD00189418

Customs Code

29182900

FAQ

What is Chicoric acid (CAS: 6537-80-0)?

Chicoric acid is a natural compound with the chemical formula C15H18O9. It is a caffeic acid derivative found in various plants, including echinacea. Chicoric acid is known for its antioxidant and anti-inflammatory properties, contributing to its role as a bioactive compound in herbal medicine and food science.

What are the main uses of Chicoric acid (CAS: 6537-80-0)?

Chicoric acid is used in pharmaceuticals for its potential health benefits, such as supporting immune function. It also finds applications in the food industry as a natural preservative and flavor enhancer. In research, it is studied for its antioxidant properties and potential therapeutic uses, including anti-cancer and anti-diabetic effects.

Is Chicoric acid (CAS: 6537-80-0) safe?

Chicoric acid, when used as directed, is generally considered safe. It has low toxicity and is well-tolerated in most cases. However, handling should be done with care, especially in high concentrations, wearing gloves and goggles to avoid skin or eye contact. Safety standards for food and pharmaceutical use are typically established by regulatory bodies like the FDA.

How should Chicoric acid (CAS: 653７-8０-0) be stored?

Chicoric acid should ideally be stored in a cool, dry, and dark place to maintain its stability and potency. It is best kept in a sealed container at temperatures below 25°C and away from moisture and direct light. Proper storage helps prevent degradation and ensures long-term quality for both research and commercial applications.