Name: Sinapic acid - matrix substance for MALDI-MS , CAS No.530-59-6
SKU: S130836
Availability: InStock

Sinapic acid - matrix substance for MALDI-MS , CAS No.530-59-6

CAS: 530-59-6 Cat. No.: S130836 分子式: C₁₁H₁₂O₅ 分子量: 224.21 Beilstein Registry Number: 2699118 EC番号: 208-487-3 PubChem CID: 637775

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Sinapic acid - matrix substance for MALDI-MS CAS No(530-59-6) by Aladdin Scientific

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注文可能

GRADE & PURITY matrix substance for MALDI-MS

Synonyms

Storage

Room temperature

Shipped In

Normal

概要 Specifications 名前と識別子 Documentation Advanced Data Taxonomic Classification 3 D構造関連ターゲット（人間）関連ターゲット（非人間）作用メカニズム証明書（CoA、COO、BSE/TSEと分析図）化学的性質と物理的性質よくある質問と記事 Citations of This Product ソリューション計算機レビュー

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Why this grade

matrix substance for MALDI-MS 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.

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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 64 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

概要

Tandem Mass Spectrometry data independently generated by Scripps Center for Metabolomics is available to view or download in PDF. 85429.pdf Tested metabolites are featured on Scripps Center for Metabolomics METLIN Metabolite Database.

Specifications

同義語

仕様と純度

matrix substance for MALDI-MS

保管条件

Room temperature

入荷

Normal

名前と識別子

パブケム・シド

504759636

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/504759636

カノニカル・スマイル

COC1=CC(=CC(=C1O)OC)C=CC(=O)O

IUPAC Name

(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid

InChIKey

PCMORTLOPMLEFB-ONEGZZNKSA-N

INCHI

1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+

異性体SMILES

COC1=CC(=CC(=C1O)OC)/C=C/C(=O)O

WGKドイツ

PubChem CID

637775

分子量

224.21

Beilstein

2699118

Reaxy-Rn

2130006

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
  - 分類 Cinnamic acids and derivatives
    - Subclass Hydroxycinnamic acids and derivatives

Kingdom	Organic compounds
Superclass	Phenylpropanoids and polyketides
分類	Cinnamic acids and derivatives
Subclass	Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Hydroxycinnamic acids
Alternative Parents	Coumaric acids and derivatives Cinnamic acids Methoxyphenols Dimethoxybenzenes Styrenes Phenoxy compounds Anisoles Alkyl aryl ethers Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Cinnamic acid - Coumaric acid or derivatives - Hydroxycinnamic acid - M-dimethoxybenzene - Dimethoxybenzene - Methoxyphenol - Phenoxy compound - Anisole - Methoxybenzene - Styrene - Phenol ether - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Organic oxygen compound - Carbonyl group - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
説明	This compound belongs to the class of organic compounds known as hydroxycinnamic acids. These are compounds containing an cinnamic acid where the benzene ring is hydroxylated.
External Descriptors	Sinapate derivatives
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

3 D構造

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Neofusicoccum parvum (61 Activities)

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Phaeoacremonium minimum (24 Activities)

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作用メカニズム

証明書（CoA、COO、BSE/TSEと分析図）

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot Number	Certificate Type	日付	商品
A2217013	Certificate of Analysis	Aug 20, 2025	S130836
A2217030	Certificate of Analysis	Aug 20, 2025	S130836
C2013154	Certificate of Analysis	Jan 22, 2024	S130836

化学的性質と物理的性質

溶解度	H2O: slightly soluble ; methanol: water: soluble; polar organic solvents: soluble
融点（°C）	202°C
分子量	224.210 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	224.068 Da
Monoisotopic Mass	224.068 Da
Topological Polar Surface Area	76.000 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	249.000
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

よくある質問と記事

Mechanisms and Applications of Feruloyl Esterase in Feed and Food Fermentation

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Structure–Property Relationships and Identification of Cinnamic Acid Derivatives: Carboxyl-Group Ionization, Aromatic-Ring Substitution, and Conjugation Effects

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Conjugation Effects Aromatic-Ring Substitution Cinnamic Acid Derivatives Carboxyl-Group Ionization

Citations of This Product

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レビュー

📚 Citations by Application

Chromatography (HPLC / GC / TLC)11

Extraction & workup solvent34

Organic synthesis — reaction medium31

Spectroscopy sample preparation17

Other applications19

Cell viability2

Drug / compound screening10

Cytotoxicity screening3

Cell proliferation2

Cancer cell line characterization2

Industrial & non-pharma application2

Controlled-release & nanoparticle carrier2

Electrochemistry & battery electrolyte2

Extracting & workup solvent1

Crystallization & recrystallization2

View all 64 citations →

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Sinapic acid - matrix substance for MALDI-MS , CAS No.530-59-6

Storage & shipping

Quality documents

Literature proof

概要

Specifications

Documentation

📋 Safety Data Sheet (SDS)

✅ Certificate of Analysis (COA)

📊 Datasheet

🔬 Specification Sheet

Advanced Data

Molarity Calculator

Dilution Calculator

Reconstitution Calculator

顧客レビュー

📚 Citations by Application

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