CAS:327-97-9 |Chlorogenic acid
Synonyms:
(1R,3R,4S,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxy-cyclohexane-1-carboxylic acid;CHLOROGENID ACID;CHLOROGENIC ACID(AHP);3-CAFFEOLYQUINICACID;3-[[3-(3,4-dihydroxyphenyl)-1-oxy-2-propenyl]oxy]-1,4,5-trihydroxy-1, [1S-(1 a , 3 β , 4 a , 5 a )];Chlorogenic Acid Hydrate;CHLOROGENIC ACID extrapure;Chlorogenic acid,3-Caffeoylquinic acid
Canonical SMILES: C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
HS Code: 29182900
Density:1.3594(roughestimate)
Boiling Point:407.55°C(roughestimate)
Refractive Index:-37°(C=1,H2O)
Melting Point: 210 °C(dec.)(lit.)
alpha: -36°(c=1,H2O)
Storage: 0-6°C
PKA: 3.91±0.50(Predicted)
Appearance: Powder,Crystals,Needlesand/orChunks
Hazard Codes: Xi
Risk Statements: 68
Safety Statements: 24/25
WGK Germany: 3