Methyl 3,4,5-trimethoxybenzoate - 10mM in DMSO , CAS No.1916-07-0

CAS: 1916-07-0 Cat. No.: M422345 Molecular Weight: 226.23 Beilstein Registry Number: 10484 EC Number: 217-629-3
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GRADE & PURITY 10mM in DMSO
Synonyms
AC-11227 | EN300-1228933 | HY-N2044 | AMY22196 | TRIMEBUTINE MALEATE IMPURITY C [EP IMPURITY] | AC-907/25014289 | QFP1LSC7TK | UNII-QFP1LSC7TK | 3,4,5-Trimethoxybenzoic Acid Methyl Ester; Methyl Eudesmate; Methyl Gallate Trimethyl Ether; Methyl Tri-O-meth
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
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Size
Status
Price
Qty
1ml
M422345-1ml
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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
AC-11227 | EN300-1228933 | HY-N2044 | AMY22196 | TRIMEBUTINE MALEATE IMPURITY C [EP IMPURITY] | AC-907/25014289 | QFP1LSC7TK | UNII-QFP1LSC7TK | 3, 4, 5-Trimethoxybenzoic Acid Methyl Ester; Methyl Eudesmate; Methyl Gallate Trimethyl Ether; Methyl Tri-O-meth
Specifications & Purity
10mM in DMSO
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers
Canonical SmilesCOC1=CC(=CC(=C1OC)OC)C(=O)OC
IUPAC Namemethyl 3,4,5-trimethoxybenzoate
InChIKeyKACHFMOHOPLTNX-UHFFFAOYSA-N
INCHI1S/C11H14O5/c1-13-8-5-7(11(12)16-4)6-9(14-2)10(8)15-3/h5-6H,1-4H3
Isomeric SMILES COC1=CC(=CC(=C1OC)OC)C(=O)OC
WGK Germany 3
RTECS DI0820000
Molecular Weight 226.23
Beilstein 10484
Reaxy-Rn 2218156
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2218156&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.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene 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  Methyl esters  Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Gallic acid or derivatives - P-methoxybenzoic acid or derivatives - M-methoxybenzoic acid or derivatives - Benzoate ester - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Benzoyl - Alkyl aryl ether - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Aromatic homomonocyclic compound
DescriptionThis 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 Structure
Interactive Chemical Structure Model





Associated Targets(Human)
ACHE Tclin Acetylcholinesterase (18204 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Boil Point(°C)185 °C/16 mmHg
Melt Point(°C)82 °C
Molecular Weight226.230 g/mol
XLogP31.700
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass226.084 Da
Monoisotopic Mass226.084 Da
Topological Polar Surface Area54.000 Ų
Heavy Atom Count16
Formal Charge0
Complexity216.000
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
Solution Calculators
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