Ethyl 3-Methyl-3-phenylglycidate (mixture of isomers) - ≥95%(GC), mixture of Cis andTrans , CAS No.77-83-8

CAS: 77-83-8 Cat. No.: A117705 Molecular Weight: 206.24 EC Number: 201-061-8
AVAILABLE TO ORDER
GRADE & PURITY ≥95%(GC) mixture of Cis andTrans
Synonyms
AI3-02458 | F88256 | 2-Oxiranecarboxylic acid, 3-methyl-3-phenyl-, ethyl ester | Ethyl(methylphenyl)glycidate | 3-methyl-3-phenyl-oxiranecarboxylic acid ethyl ester | UD51D5KR4A | 2,3-Epoxy-3-phenylbutyric Acid Ethyl Ester | cis-3-Phenyl-3-methylglycidic
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
25ml
A117705-25ml
3
$15.90
50ml
A117705-50ml
4
$26.90
250ml
A117705-250ml
1
$49.90
500ml
A117705-500ml
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$81.90
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Why this grade

≥95%(GC), mixture of Cis andTrans for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at 2-8°C,Argon charged Ships Wet ice 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
AI3-02458 | F88256 | 2-Oxiranecarboxylic acid, 3-methyl-3-phenyl-, ethyl ester | Ethyl(methylphenyl)glycidate | 3-methyl-3-phenyl-oxiranecarboxylic acid ethyl ester | UD51D5KR4A | 2, 3-Epoxy-3-phenylbutyric Acid Ethyl Ester | cis-3-Phenyl-3-methylglycidic
Specifications & Purity
≥95%(GC), mixture of Cis andTrans
Storage
Store at 2-8°C, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥95%(GC)
Names and Identifiers
Pubchem Sid488180079
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488180079
Canonical SmilesCCOC(=O)C1C(O1)(C)C2=CC=CC=C2
IUPAC Nameethyl 3-methyl-3-phenyloxirane-2-carboxylate
InChIKeyLQKRYVGRPXFFAV-UHFFFAOYSA-N
INCHI1S/C12H14O3/c1-3-14-11(13)10-12(2,15-10)9-7-5-4-6-8-9/h4-8,10H,3H2,1-2H3
Isomeric SMILES CCOC(=O)C1C(O1)(C)C2=CC=CC=C2
WGK Germany 2
RTECS MW5250000
Molecular Weight 206.24
Reaxy-Rn 12299
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=12299&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ 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
SuperclassOrganoheterocyclic compounds
ClassEpoxides
SubclassOxirane carboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentOxirane carboxylic acids
Alternative Parents Benzene and substituted derivatives  Carboxylic acid esters  Oxacyclic compounds  Monocarboxylic acids and derivatives  Dialkyl ethers  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Benzenoid - Oxirane carboxylic acid - Monocyclic benzene moiety - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as oxirane carboxylic acids. These are compounds containing an oxirane ring bearing a carboxylic acid group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
THRB Tclin Thyroid hormone receptor beta-1 (7926 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:

Find and download the COA for your product by matching the lot number on the packaging.

9 results found

Lot NumberCertificate TypeDateItem
K2525225Certificate of AnalysisJul 12, 2024 A117705
K2525226Certificate of AnalysisJul 12, 2024 A117705
K2525227Certificate of AnalysisJul 12, 2024 A117705
G1918229Certificate of AnalysisMay 08, 2023 A117705
C2301615Certificate of AnalysisMar 07, 2023 A117705
K2211020Certificate of AnalysisOct 28, 2022 A117705
K2211021Certificate of AnalysisOct 28, 2022 A117705
K2211024Certificate of AnalysisOct 28, 2022 A117705
K2211025Certificate of AnalysisOct 28, 2022 A117705
Chemical and Physical Properties
SensitivityMoisture Sensitive
Refractive Index1.504-1.513
Flash Point(°F)>110 °C
Flash Point(°C)>110°C
Boil Point(°C)272-275°C
Molecular Weight206.240 g/mol
XLogP31.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass206.094 Da
Monoisotopic Mass206.094 Da
Topological Polar Surface Area38.800 Ų
Heavy Atom Count15
Formal Charge0
Complexity245.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
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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