| Identification | Back Directory | [Name]
[1S-(1alpha,3beta,4beta,5alpha)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid | [CAS]
534-61-2 | [Synonyms]
Isochlorogenic
ISOCHLOROGENIC ACID A(RG)
(1S)-3β-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1α,4β,5α-trihydroxycyclohexane-1β-carboxylic acid
[1S-(1alpha,3beta,4beta,5alpha)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid | [EINECS(EC#)]
208-603-2 | [Molecular Formula]
C16H18O9 | [MOL File]
534-61-2.mol | [Molecular Weight]
354.309 |
| Chemical Properties | Back Directory | [Boiling point ]
665.0±55.0 °C(Predicted) | [density ]
1.65±0.1 g/cm3(Predicted) | [solubility ]
>51.6mg/ml in DMSO | [form ]
powder | [pka]
3.91±0.50(Predicted) | [color ]
White | [LogP]
-0.356 (est) | [CAS DataBase Reference]
534-61-2 |
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