Methyl isoeugenol - 10mM in DMSO , CAS No.93-16-3

CAS: 93-16-3 Cat. No.: M426976 Molecular Weight: 178.23 EC Number: 202-224-6
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GRADE & PURITY 10mM in DMSO
Synonyms
DTXCID4031194 | FEMA NO. 2476, E- | 1,2-dimethoxy-4-[(1E)-prop-1-en-1-yl]benzene | AS-56928 | Isomethyleugenol | (E)-1,2-DIMETHOXY-4-(1-PROPENYL)BENZENE | 1-(3,4-Dimethoxyphenyl)-1-propene | BENZENE,1,2-DIMETHOXY,4-PROPENYL ISOEUGENOL,METHYL ETHER | W-1
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1ml
M426976-1ml
1

$58.90

$69.90
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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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
DTXCID4031194 | FEMA NO. 2476, E- | 1, 2-dimethoxy-4-[(1E)-prop-1-en-1-yl]benzene | AS-56928 | Isomethyleugenol | (E)-1, 2-DIMETHOXY-4-(1-PROPENYL)BENZENE | 1-(3, 4-Dimethoxyphenyl)-1-propene | BENZENE, 1, 2-DIMETHOXY, 4-PROPENYL ISOEUGENOL, METHYL ETHER | W-1
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 SmilesCC=CC1=CC(=C(C=C1)OC)OC
IUPAC Name1,2-dimethoxy-4-[(E)-prop-1-enyl]benzene
InChIKeyNNWHUJCUHAELCL-SNAWJCMRSA-N
INCHI1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3/b5-4+
Isomeric SMILES C/C=C/C1=CC(=C(C=C1)OC)OC
WGK Germany 2
RTECS CZ7000000
Molecular Weight 178.23
Reaxy-Rn 880472
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=880472&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.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassMethoxybenzenes
Intermediate Tree Nodes Not available
Direct ParentDimethoxybenzenes
Alternative Parents Styrenes  Phenoxy compounds  Anisoles  Alkyl aryl ethers  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Styrene - Phenol ether - Anisole - Alkyl aryl ether - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
External Descriptors isomethyleugenol
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
A549 (127892 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KB (17409 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Saccharomyces cerevisiae (19171 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Candida albicans (78123 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
Refractive Index1.569
Flash Point(°F)235.4 °F
Flash Point(°C)113 °C
Boil Point(°C)262-264°C
Melt Point(°C)98-100°C
Molecular Weight178.230 g/mol
XLogP32.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass178.099 Da
Monoisotopic Mass178.099 Da
Topological Polar Surface Area18.500 Ų
Heavy Atom Count13
Formal Charge0
Complexity165.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds1
Covalently-Bonded Unit Count1
Citations of This Product
References
1. Guangping Xia, Guihua Ruan, Yipeng Huang, Haoyun Hu, Shi Yu, Bingmei Lai, Zhenyu Li, Yun Zhang, Ningli Tang.  (2023)  Highly efficient enrichment of eugenol anesthetics in aquatic products using magnetic nanospheres decorated covalent organic framework microflowers.  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2023.109362]
2. Jianbin Ju, Yuji Ruan, Huifeng Deng, Xiaowen Huang, Guihua Ruan, Yipeng Huang.  (2025)  Facile synthesis of thiocyano-functionalized dendritic mesoporous silica spheres for efficient extraction of eugenol anesthetics from aquatic products.  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2025.113078]
Solution Calculators
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