3,4,5-Trimethoxybenzoic Acid Ethyl Ester - ≥96%(GC) , CAS No.6178-44-5

CAS: 6178-44-5 Cat. No.: E137645 분자식: C12H16O5 분자량: 240.26 Beilstein Registry Number: 10(4)2002
주문 가능
GRADE & PURITY ≥96%(GC)
Synonyms
Ethyl 3,4,5-Trimethoxybenzoate | HY-W012092 | 3,4,5-Trimethoxybenzoic Acid Ethyl Ester | Z53836337 | Ethyl 3,4,5-trimethoxybenzoate; | FT-0636014 | ethyltrimethoxy benzoate | AMY32800 | DTXSID50282612 | T2015 | NSC26825 | NSC-26825 | AC-11226 | SCHEMBL441
Storage
Room temperature
Shipped In
Normal
★
Size
USA
독일 (EU)*
Price
Qty
1g
E137645-1g
1 재고 있음
—

US$15.90

US$23.90
저장 US$8.00 (33.47%)
5g
E137645-5g
1 재고 있음
—

US$24.90

US$37.90
저장 US$13.00 (34.30%)
25g
E137645-25g
주문제작 · 8~12주

US$75.90

US$113.90
저장 US$38.00 (33.36%)
100g
E137645-100g
주문제작 · 8~12주

US$242.90

US$364.90
저장 US$122.00 (33.43%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥96%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

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.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

동의어
Ethyl 3,4,5-Trimethoxybenzoate | HY-W012092 | 3,4,5-Trimethoxybenzoic Acid Ethyl Ester | Z53836337 | Ethyl 3,4,5-trimethoxybenzoate; | FT-0636014 | ethyltrimethoxy benzoate | AMY32800 | DTXSID50282612 | T2015 | NSC26825 | NSC-26825 | AC-11226 | SCHEMBL441
사양 및 순도
≥96%(GC)
보관 조건
Room temperature
배송
Normal
순수함
≥96%(GC)
이름과 식별자
Pubchem Sid528757854
정식 스마일CCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC
IUPAC Nameethyl 3,4,5-trimethoxybenzoate
InChIKeyUEOFNBCUGJADBM-UHFFFAOYSA-N
INCHI1S/C12H16O5/c1-5-17-12(13)8-6-9(14-2)11(16-4)10(7-8)15-3/h6-7H,5H2,1-4H3
이성체 SMILES CCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC
분자량 240.26
Beilstein 10(4)2002
Reaxy-Rn 2137087
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2137087&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
분류Benzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Hydroxybenzoic acid derivatives
Direct ParentGallic acid and derivatives
Alternative Parents P-methoxybenzoic acids and derivatives  M-methoxybenzoic acids and derivatives  Benzoic acid esters  Phenoxy compounds  Methoxybenzenes  Benzoyl derivatives  Anisoles  Alkyl aryl ethers  Carboxylic acid esters  Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Gallic acid or derivatives - M-methoxybenzoic acid or derivatives - P-methoxybenzoic acid or derivatives - Benzoate ester - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Methoxybenzene - Alkyl aryl ether - Carboxylic acid ester - Ether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
설명This compound belongs to the class of organic compounds known as gallic acid and derivatives. These are compounds containing a 3,4,5-trihydroxybenzoic acid moiety.
External Descriptors Not available
3D 구조
상호 작용 화학 구조 모델





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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.

2 results found

Lot NumberCertificate Type날짜항목
H2402226Certificate of AnalysisMay 11, 2026 E137645
H2402227Certificate of AnalysisMay 11, 2026 E137645
화학 및 물리적 특성
분자량240.250 g/mol
XLogP32.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass240.1 Da
Monoisotopic Mass240.1 Da
Topological Polar Surface Area54.000 Ų
Heavy Atom Count17
Formal Charge0
Complexity229.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
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