ChemicalBook--->CAS DataBase List--->1782-55-4

1782-55-4

1782-55-4 Structure

1782-55-4 Structure
IdentificationBack Directory
[Name]

5-hydroxyferulic acid
[CAS]

1782-55-4
[Synonyms]

5-hydroxyferulic acid
3-Methoxycaffeic acid
3-(3,4-Dihydroxy-5-methoxyphenyl)-2-propenoic acid
3,4-Dihydroxy-5-methoxycinnamic acid >=95.0% (HPLC)
2-Propenoic acid, 3-(3,4-dihydroxy-5-methoxyphenyl)-
[Molecular Formula]

C10H10O5
[MDL Number]

MFCD03002791
[MOL File]

1782-55-4.mol
[Molecular Weight]

210.18
Chemical PropertiesBack Directory
[Melting point ]

168-170 °C
[Boiling point ]

449.1±45.0 °C(Predicted)
[density ]

1.440±0.06 g/cm3(Predicted)
[form ]

Solid
[pka]

4.53±0.10(Predicted)
[color ]

Off-white to light yellow
[BRN ]

2697317
[Major Application]

metabolomics
vitamins, nutraceuticals, and natural products
[InChI]

1S/C10H10O5/c1-15-8-5-6(2-3-9(12)13)4-7(11)10(8)14/h2-5,11,14H,1H3,(H,12,13)/b3-2+
[InChIKey]

YFXWTVLDSKSYLW-NSCUHMNNSA-N
[SMILES]

COc1cc(\C=C\C(O)=O)cc(O)c1O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

metabolomics
vitamins, nutraceuticals, and natural products
[Definition]

ChEBI: Ferulic acid in which the ring hydrogen at position 5 is substituted by hydroxy.
[Biological Activity]

Secondary plant metabolite of the phenylpropanoid pathway.
[IC 50]

Human Endogenous Metabolite
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