Methyl Caffeate - ≥98%(T) , CAS No.3843-74-1

Name: Methyl Caffeate - ≥98%(T) , CAS No.3843-74-1
SKU: M158462
Availability: InStock

CAS: 3843-74-1 Cat. No.: M158462 Fórmula: C₁₀H₁₀O₄ Peso molecular: 194.19 Número EC: 808-143-8

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Methyl Caffeate - ≥98%(T) CAS No(3843-74-1) by Aladdin Scientific

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Disponible para pedir

GRADE & PURITY ≥98%(T)

Synonyms

Storage

Room temperature

Shipped In

Normal

Specifications Nombres e identificadores Documentation Advanced Data Taxonomic Classification Estructura 3D Objetivos asociados (humanos) Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Citations of This Product Calculadoras de soluciones Reseñas Preguntas frecuentes

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Why this grade

≥98%(T) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 8 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos

Especificaciones y pureza

≥98%(T)

Mecanismos bioquímicos y fisiológicos

Naturally occurring ester of caffeic acid. Antihyperglycemic and antidiabetic effects in vivo. Oncoprotective effects in vitro.

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Tipo de acción

INHIBITOR

Nota

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Pureza

≥98%(T)

Nombres e identificadores

Pubchem Sid

488191143

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488191143

Sonrisas canónicas

COC(=O)C=CC1=CC(=C(C=C1)O)O

IUPAC Name

methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

InChIKey

OCNYGKNIVPVPPX-HWKANZROSA-N

INCHI

1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+

Isómeros SMILES

COC(=O)/C=C/C1=CC(=C(C=C1)O)O

CAS alternativo

67667-67-8

Peso molecular

194.19

Reaxy-Rn

2100051

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2100051&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Phenylpropanoids and polyketides
  - Clase Cinnamic acids and derivatives
    - Subclass Hydroxycinnamic acids and derivatives

Kingdom	Organic compounds
Superclass	Phenylpropanoids and polyketides
Clase	Cinnamic acids and derivatives
Subclass	Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Coumaric acids and derivatives
Alternative Parents	Cinnamic acid esters Styrenes Catechols Fatty acid esters 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Methyl esters Enoate esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Coumaric acid or derivatives - Cinnamic acid ester - Catechol - Styrene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Fatty acid ester - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organic oxide - Aromatic homomonocyclic compound
Descripción	This compound belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.
External Descriptors	alkyl caffeate ester
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Estructura 3D

Objetivos asociados (humanos)

APP Tclin Amyloid-beta A4 protein (8510 Activities)

Discover Target: APP

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

BeWo (124 Activities)

Lot Number	Certificate Type	Fecha	Articulo
K2222568	Certificate of Analysis	Sep 03, 2026	M158462
K2222571	Certificate of Analysis	Sep 03, 2026	M158462
F2523522	Certificate of Analysis	May 26, 2025	M158462
F2523523	Certificate of Analysis	May 26, 2025	M158462
E2429556	Certificate of Analysis	May 11, 2024	M158462
E2429557	Certificate of Analysis	May 11, 2024	M158462
F23271084	Certificate of Analysis	Apr 20, 2023	M158462
F23271085	Certificate of Analysis	Apr 20, 2023	M158462
A2331186	Certificate of Analysis	Feb 03, 2023	M158462
K2222567	Certificate of Analysis	Oct 28, 2022	M158462
K2222572	Certificate of Analysis	Oct 28, 2022	M158462
H1821124	Certificate of Analysis	Jun 20, 2022	M158462
C2205479	Certificate of Analysis	Feb 14, 2022	M158462
C2205483	Certificate of Analysis	Feb 14, 2022	M158462

Punto de fusión (°C)	160℃
Peso molecular	194.180 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	194.058 Da
Monoisotopic Mass	194.058 Da
Topological Polar Surface Area	66.800 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	224.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	1
Covalently-Bonded Unit Count	1

Methyl Caffeate - ≥98%(T) , CAS No.3843-74-1

Storage & shipping

Quality documents

Literature proof

Specifications

Documentation

📋 Safety Data Sheet (SDS)

✅ Certificate of Analysis (COA)

📊 Datasheet

🔬 Specification Sheet

Advanced Data

Molarity Calculator

Dilution Calculator

Reconstitution Calculator

Reseñas de cliente

Preguntas frecuentes

📚 Citations by Application

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