2-(4-Methoxyphenyl)-malonic acid diethyl ester - ≥95% , CAS No.23197-67-3

CAS: 23197-67-3 Cat. No.: M183026 Molecular Weight: 266.3
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
AKOS005259930 | SCHEMBL1043694 | tert-Boc-aminooxyacetic acid? | Diethyl-2-p-methoxyphenylmalonate | DTXSID70382865 | MFCD04038965 | Propanedioic acid,2-(4-methoxyphenyl)-,1,3-diethyl ester | PS-7312 | D76037 | Diethyl 2-(4-methoxyphenyl)malonate | ethyl
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
M183026-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$103.90

$121.90
Save $18.00 (14.77%)
5g
M183026-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$338.90

$396.90
Save $58.00 (14.61%)
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Why this grade

≥95% 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

Synonyms
AKOS005259930 | SCHEMBL1043694 | tert-Boc-aminooxyacetic acid? | Diethyl-2-p-methoxyphenylmalonate | DTXSID70382865 | MFCD04038965 | Propanedioic acid, 2-(4-methoxyphenyl)-, 1, 3-diethyl ester | PS-7312 | D76037 | Diethyl 2-(4-methoxyphenyl)malonate | ethyl
Specifications & Purity
≥95%
Storage
Room temperature
Shipped In
Normal
Purity
≥95%
Names and Identifiers
Canonical SmilesCCOC(=O)C(C1=CC=C(C=C1)OC)C(=O)OCC
IUPAC Namediethyl 2-(4-methoxyphenyl)propanedioate
InChIKeyQXHBIWJHLHGDEO-UHFFFAOYSA-N
INCHI1S/C14H18O5/c1-4-18-13(15)12(14(16)19-5-2)10-6-8-11(17-3)9-7-10/h6-9,12H,4-5H2,1-3H3
Isomeric SMILES CCOC(=O)C(C1=CC=C(C=C1)OC)C(=O)OCC
Molecular Weight 266.3
Reaxy-Rn 664653
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=664653&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
ClassPhenol ethers
SubclassAnisoles
Intermediate Tree Nodes Not available
Direct ParentAnisoles
Alternative Parents Phenoxy compounds  Methoxybenzenes  Alkyl aryl ethers  Dicarboxylic acids and derivatives  1,3-dicarbonyl compounds  Carboxylic acid esters  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - 1,3-dicarbonyl compound - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Ether - Organic oxygen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight266.290 g/mol
XLogP32.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass266.115 Da
Monoisotopic Mass266.115 Da
Topological Polar Surface Area61.800 Ų
Heavy Atom Count19
Formal Charge0
Complexity276.000
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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