Ethyl 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate - ≥98% , CAS No.53715-64-3

CAS: 53715-64-3 Cat. No.: E185072 Molecular Weight: 247.31 EC Number: 161-777-0
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
MFCD00141953 | D86794 | 2,3,4-Tri-O-benzoyl-alpha-D-glucopyranuronicacidmethylestertrichloroacetimidate | A829747 | HMS565B08 | FYPLITQTMHJFKK-UHFFFAOYSA-N | HMS2649D20 | SMR000333453 | STL141126 | Maybridge1_008302 | AMY1756 | EN300-64122 | J-521046 | 4-
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
E185072-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$94.90
5g
E185072-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$329.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads 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
MFCD00141953 | D86794 | 2, 3, 4-Tri-O-benzoyl-alpha-D-glucopyranuronicacidmethylestertrichloroacetimidate | A829747 | HMS565B08 | FYPLITQTMHJFKK-UHFFFAOYSA-N | HMS2649D20 | SMR000333453 | STL141126 | Maybridge1_008302 | AMY1756 | EN300-64122 | J-521046 | 4-
Specifications & Purity
≥98%
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥98%
Names and Identifiers
Canonical SmilesCCOC(=O)C1=C(N=C(S1)C2=CC=CC=C2)C
IUPAC Nameethyl 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate
InChIKeyFYPLITQTMHJFKK-UHFFFAOYSA-N
INCHI1S/C13H13NO2S/c1-3-16-13(15)11-9(2)14-12(17-11)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3
Isomeric SMILES CCOC(=O)C1=C(N=C(S1)C2=CC=CC=C2)C
Molecular Weight 247.31
Reaxy-Rn 213362
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=213362&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.

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
SuperclassOrganoheterocyclic compounds
ClassAzoles
SubclassThiazoles
Intermediate Tree Nodes Not available
Direct ParentThiazolecarboxylic acids and derivatives
Alternative Parents 2,4,5-trisubstituted thiazoles  Benzene and substituted derivatives  Heteroaromatic compounds  Carboxylic acid esters  Monocarboxylic acids and derivatives  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents 2,4,5-trisubstituted 1,3-thiazole - Thiazolecarboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as thiazolecarboxylic acids and derivatives. These are heterocyclic compounds containing a thiazole ring which bears a carboxylic acid group (or a derivative thereof).
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
POLI Tchem DNA polymerase iota (116820 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KDM4A Tchem Lysine-specific demethylase 4A (52245 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SMAD3 Tchem Mothers against decapentaplegic homolog 3 (68039 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CBX1 Tbio Chromobox protein homolog 1 (92434 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
ampC Beta-lactamase AmpC (62480 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Plasmodium falciparum (966862 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Luciferin 4-monooxygenase (66902 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 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.

3 results found

Lot NumberCertificate TypeDateItem
A2626472Certificate of AnalysisNov 19, 2025 E185072
A2626491Certificate of AnalysisNov 19, 2025 E185072
A2626492Certificate of AnalysisNov 19, 2025 E185072
Chemical and Physical Properties
Boil Point(°C)372.9°C at 760 mmHg
Melt Point(°C)36 °C
Molecular Weight247.310 g/mol
XLogP33.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass247.067 Da
Monoisotopic Mass247.067 Da
Topological Polar Surface Area67.400 Ų
Heavy Atom Count17
Formal Charge0
Complexity266.000
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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