trans-Urocanic Acid - ≥98%(HPLC)(T) , CAS No.3465-72-3

Name: trans-Urocanic Acid - ≥98%(HPLC)(T) , CAS No.3465-72-3
SKU: T162071
Availability: InStock

CAS: 3465-72-3 Cat. No.: T162071 Fórmula: C₆H₆N₂O₂ Peso molecular: 138.13

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trans-Urocanic Acid - ≥98%(HPLC)(T) CAS No(3465-72-3) by Aladdin Scientific

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Disponível para encomenda

GRADE & PURITY ≥98%(HPLC)(T)

Synonyms

2-Propenoic acid, 3-(1H-imidazol-4-yl)-, (E)- | MFCD00005203 | Q60998685 | Urocaninic acid | AMY7015 | CHEBI:27248 | MLS000069482 | CAS-104-98-3 | Imidazole-4-acrylate | SMR000059098 | UNII-G8D26XJJ3B | 1H-ImidaZole-4-acrylic acid (Urocanic acid) | HMS223

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications Nomes e identificadores Documentation Advanced Data Taxonomic Classification Estrutura 3D Alvos associados (humanos) Alvos associados (não humanos) Mecanismos de ação Certificados（CoA,COO,BSE/TSE e Mapa de Análise) Propriedades químicas e físicas FAQs e artigos Citations of This Product Calculadoras de soluções Revisões

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Why this grade

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

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Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

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Quality documents

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

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Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos

Especificações e pureza

≥98%(HPLC)(T)

Condições de armazenamento de armazenamento

Store at 2-8°C

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%(HPLC)(T)

Nomes e identificadores

Pubchem Sid

508812823

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508812823

Sorrisos canónicos

C1=C(NC=N1)C=CC(=O)O

IUPAC Name

(E)-3-(1H-imidazol-5-yl)prop-2-enoic acid

InChIKey

LOIYMIARKYCTBW-OWOJBTEDSA-N

INCHI

1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)/b2-1+

SMILES isoméricas

C1=C(NC=N1)/C=C/C(=O)O

Peso molecular

138.13

Reaxy-Rn

606934

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=606934&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 Organoheterocyclic compounds
  - Classe Azoles
    - Subclass Imidazoles
      - Level5 Substituted imidazoles
        Level6 Imidazolyl carboxylic acids and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Classe	Azoles
Subclass	Imidazoles
Intermediate Tree Nodes	Substituted imidazoles
Direct Parent	Imidazolyl carboxylic acids and derivatives
Alternative Parents	Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Imidazolyl carboxylic acid derivative - Heteroaromatic compound - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic heteromonocyclic compound
Descrição	This compound belongs to the class of organic compounds known as imidazolyl carboxylic acids and derivatives. These are organic compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an imidazole ring.
External Descriptors	urocanic acid
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

Estrutura 3D

Alvos associados (humanos)

SLC6A1 Tclin GABA transporter 1 (308 Activities)

Discover Target: SLC6A1

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

ARSA Tbio Cerebroside-sulfatase (655 Activities)

Discover Target: ARSA

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

SLC6A11 Tchem GABA transporter 3 (176 Activities)

Discover Target: SLC6A11

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

A498 (42825 Activities)

Lot Number	Certificate Type	Data	Item
B2318190	Certificate of Analysis	Feb 06, 2023	T162071
B2318191	Certificate of Analysis	Feb 06, 2023	T162071
B2318344	Certificate of Analysis	Feb 06, 2023	T162071

Sensibilidade	heat sensitive
Ponto de fusão (°C)	225 °C
Peso molecular	138.120 g/mol
XLogP3	0.000
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	138.043 Da
Monoisotopic Mass	138.043 Da
Topological Polar Surface Area	66.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	156.000
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

trans-Urocanic Acid - ≥98%(HPLC)(T) , CAS No.3465-72-3

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

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