NCS-382 - ≥99%(HPLC) , CAS No.520505-01-5

CAS: 520505-01-5 Cat. No.: N288724 분자식: C13H14O3 분자량: 218.25
주문 가능
GRADE & PURITY ≥99%(HPLC)
Synonyms
Biomol-NT_000263 | AKOS024458646 | Fast Light Yellow 5GL | BRD-A67433117-001-01-8 | 2-[(6E)-5-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ylidene]acetic acid | Acetic acid, (5,7,8,9-tetrahydro-5-hydroxy-6H-benzocyclohepten-6-ylidene)- | (E)-2-(5-Hydro
Storage
Store at 2-8°C,Desiccated
Shipped In
Wet ice
★
Size
USA
독일 (EU)*
Price
Qty
10mg
N288724-10mg
주문제작 · 8~12주
US$202.90
50mg
N288724-50mg
주문제작 · 8~12주
US$844.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥99%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Desiccated Ships Wet ice 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

동의어
Biomol-NT_000263 | AKOS024458646 | Fast Light Yellow 5GL | BRD-A67433117-001-01-8 | 2-[(6E)-5-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ylidene]acetic acid | Acetic acid, (5,7,8,9-tetrahydro-5-hydroxy-6H-benzocyclohepten-6-ylidene)- | (E)-2-(5-Hydro
사양 및 순도
≥99%(HPLC)
생화학 및 생리적 메커니즘
γ-Hydroxybutyric acid antagonist, anticonvulsant.
보관 조건
Store at 2-8°C,Desiccated
배송
Wet ice
이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.
작업 유형
ANTAGONIST
순수함
≥99%(HPLC)
이름과 식별자
정식 스마일C1CC2=CC=CC=C2C(C(=CC(=O)O)C1)O
IUPAC Name(2E)-2-(5-hydroxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-ylidene)acetic acid
InChIKeyUADPGHINQMWEAG-CSKARUKUSA-N
INCHI1S/C13H14O3/c14-12(15)8-10-6-3-5-9-4-1-2-7-11(9)13(10)16/h1-2,4,7-8,13,16H,3,5-6H2,(H,14,15)/b10-8+
이성체 SMILES C1CC2=CC=CC=C2C(/C(=C/C(=O)O)/C1)O
분자량 218.25
Reaxy-Rn 8840113
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8840113&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

KingdomOrganic compounds
SuperclassBenzenoids
분류Not available
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzenoids
Alternative Parents Secondary alcohols  Monocarboxylic acids and derivatives  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic homopolycyclic compounds
Substituents Benzenoid - Secondary alcohol - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aromatic homopolycyclic compound
설명This compound belongs to the class of organic compounds known as benzenoids. These are aromatic compounds containing one or more benzene rings.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
CAMK2A Tchem CaM kinase II alpha (1938 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
관련 대상(비인간)
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Gamma-hydroxybutyrate receptor (68 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDCK (10148 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
화학 및 물리적 특성
용해성Solvent:DMSO, Max Conc. mg/mL: 21.83, Max Conc. mM: 100
분자량218.250 g/mol
XLogP31.500
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass218.094 Da
Monoisotopic Mass218.094 Da
Topological Polar Surface Area57.500 Ų
Heavy Atom Count16
Formal Charge0
Complexity296.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds1
Covalently-Bonded Unit Count1
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