| Identification | More | [Name]
3,4-Dimethoxyhydrocinnamic acid | [CAS]
2107-70-2 | [Synonyms]
3-(3',4'-DIMETHOXYPHENYL)PROPANOIC ACID
3-(3,4-DIMETHOXYPHENYL)PROPANOIC ACID
3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID
3,4-DIMETHOXYHYDROCINNAMIC ACID
AKOS 219-05
AKOS BBS-00007898
AKOS BC-2703
LABOTEST-BB LT00453637
Benzenepropanoic acid, 3,4-dimethoxy-
3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID, 9 9%
3-(3,4-Dimethoxyphenyl)
3-(3,4-Dimethoxyphenyl)propionic acid 99%
3-(3,4-DIMETHOXYPHENYL) PROPIONIC ACID (HAZARDOUS)
3-(3,4-DIMETHOXYPHENYL) PROPIONIC ACID (NON-HAZARD
3,4-Dimethoxybenzenepropionic Acid
3,4-Dimethoxydihydrocinnamic Acid
NSC 76043
4-Methoxydihydroferulic acid | [EINECS(EC#)]
218-288-3 | [Molecular Formula]
C11H14O4 | [MDL Number]
MFCD00002774 | [Molecular Weight]
210.23 | [MOL File]
2107-70-2.mol |
| Chemical Properties | Back Directory | [Appearance]
Slightly beige crystalline powder | [Melting point ]
96-97 °C(lit.)
| [Boiling point ]
309.75°C (rough estimate) | [density ]
1.1922 (rough estimate) | [refractive index ]
1.5384 (estimate) | [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
DMSO, Water | [form ]
Crystalline Powder | [pka]
4.71±0.10(Predicted) | [color ]
Slightly beige | [BRN ]
2696272 | [InChI]
InChI=1S/C11H14O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3,5,7H,4,6H2,1-2H3,(H,12,13) | [InChIKey]
LHHKQWQTBCTDQM-UHFFFAOYSA-N | [SMILES]
C1(CCC(O)=O)=CC=C(OC)C(OC)=C1 | [CAS DataBase Reference]
2107-70-2(CAS DataBase Reference) | [NIST Chemistry Reference]
3-(3,4-Dimethoxyphenyl)-propionic acid(2107-70-2) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes . | [WGK Germany ]
3
| [Hazard Note ]
Irritant | [HazardClass ]
IRRITANT | [HS Code ]
29189090 |
| Hazard Information | Back Directory | [Chemical Properties]
Slightly beige crystalline powder | [Uses]
3-(3,4-Dimethoxyphenyl)propanoic Acid is one of the novel circulating coffee metabolites in human plasma. | [Definition]
ChEBI: A monocarboxylic acid that is propanoic acid substituted by a 3,4-dimethoxyphenyl group at position 3. | [General Description]
3-(3,4-Dimethoxyphenyl)propionic acid (3,4-Dimethoxyhydrocinnamic acid) forms complex with copper (II). | [in vivo]
3-(3,4-Dimethoxyphenyl)propanoic acid (50, 150 mg/kg of iv or 50, 150, 200 mg/kg of orally) achieves concentrations significantly higher than targeted plasma levels for several hours after single 50 to 150 mg/kg doses[1]. | [storage]
Store at -20°C |
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