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

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

CAS: 530-59-6 Cat. No.: S130836 분자식: C₁₁H₁₂O₅ 분자량: 224.21 Beilstein Registry Number: 2699118 EC 번호: 208-487-3 PubChem CID: 637775

64 Citations COA

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

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주문 가능

GRADE & PURITY matrix substance for MALDI-MS

Synonyms

Storage

Room temperature

Shipped In

Normal

개요 Specifications 이름과 식별자 Documentation Advanced Data Taxonomic Classification 3D 구조 관련 대상(인간) 관련 대상(비인간) 작용 메커니즘 인증서(CoA, COO, BSE/TSE 및 분석 차트) 화학 및 물리적 특성 자주 묻는 질문과 기사 Citations of This Product 솔루션 계산기 리뷰

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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.

개요

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

동의어

사양 및 순도

matrix substance for MALDI-MS

보관 조건

Room temperature

배송

Normal

이름과 식별자

Pubchem Sid

504759636

Pubchem Sid Url

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

정식 스마일

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+

이성체 SMILES

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

WGK 독일

PubChem CID

637775

분자량

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
  - 분류 Cinnamic acids and derivatives
    - Subclass Hydroxycinnamic acids and derivatives

Kingdom	Organic compounds
Superclass	Phenylpropanoids and polyketides
분류	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
설명	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

3D 구조

관련 대상(비인간)

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Pkm Pyruvate kinase isozymes M1/M2 (66 Activities)

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MAL62 Alpha-glucosidase MAL62 (106 Activities)

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Ralstonia solanacearum (520 Activities)

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Staphylococcus aureus (210822 Activities)

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Streptococcus pyogenes (16140 Activities)

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Mus musculus (284745 Activities)

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RBL-2H3 (1162 Activities)

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Lasiodiplodia theobromae (193 Activities)

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Brain (1 Activities)

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Aorta (2975 Activities)

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Diplodia seriata (145 Activities)

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Diplodia mutila (102 Activities)

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Neofusicoccum luteum (172 Activities)

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Botryosphaeria dothidea (71 Activities)

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Neofusicoccum parvum (61 Activities)

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Phaeoacremonium minimum (24 Activities)

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작용 메커니즘

인증서(CoA, COO, BSE/TSE 및 분석 차트)

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	날짜	항목
A2217013	Certificate of Analysis	Aug 20, 2025	S130836
A2217030	Certificate of Analysis	Aug 20, 2025	S130836
C2013154	Certificate of Analysis	Jan 22, 2024	S130836

화학 및 물리적 특성

용해성	H2O: slightly soluble ; methanol: water: soluble; polar organic solvents: soluble
녹는점(°C)	202°C
분자량	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

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Citations of This Product

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리뷰

📚 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

개요

Specifications

Documentation

📋 Safety Data Sheet (SDS)

✅ Certificate of Analysis (COA)

📊 Datasheet

🔬 Specification Sheet

Advanced Data

Molarity Calculator

Dilution Calculator

Reconstitution Calculator

고객 리뷰

📚 Citations by Application

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