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Ethyl thiophene-2-glyoxylate - 97%, high purity , CAS No.4075-58-5

COA

Grade & Purity:

≥97%

Cas Number: 4075-58-5
Molecular Weight: 184.22
PubChem CID: 77693
PubChem SID: 488185450

In stock

Item Number

E331015

Grouped product items
SKU	Size	Availability	Price
E331015-1g	1g	5	$12.90
E331015-5g	5g	5	$49.90
E331015-10g	10g	5	$76.90
E331015-25g	25g	4	$171.90

Discover Ethyl thiophene-2-glyoxylate by Aladdin Scientific in 97% for only $12.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	Ethyl .alpha.-oxothiophen-2-acetate \| NCGC00015410-04 \| EINECS 223-793-7 \| 8-(2-Hydroxy-3-(isopropylamino)propoxy)chroman-3-yl nitrate \| THIOPHENE-2-GLYOXYLIC ACID ETHYL ESTER \| Ethyl oxo(2-thienyl)acetate # \| Ethyl alpha-oxothiophen-2-acetate \| thiopheny
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	Application Ethyl thiophene-2-glyoxylate is used for drug discovery using chemic informatics-based design and it is used as a catalyst, synthesis of raw material.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds
      - Level5 Ketones
        Level6 Aryl ketones

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Carbonyl compounds
Intermediate Tree Nodes	Ketones
Direct Parent	Aryl ketones
Alternative Parents	Alpha-keto acids and derivatives Thiophenes Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Aryl ketone - Keto acid - Alpha-keto acid - Heteroaromatic compound - Thiophene - Carboxylic acid ester - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as aryl ketones. These are organic aromatic compounds that contain a ketone group substituted at one C-atom with an aryl group. They have the generic structure RC(=O)R', where R = aryl group and R'=organyl group.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488185450
IUPAC Name	ethyl 2-oxo-2-thiophen-2-ylacetate
INCHI	InChI=1S/C8H8O3S/c1-2-11-8(10)7(9)6-4-3-5-12-6/h3-5H,2H2,1H3
InChIKey	GHOVLEQTRNXASK-UHFFFAOYSA-N
Smiles	CCOC(=O)C(=O)C1=CC=CS1
Isomeric SMILES	CCOC(=O)C(=O)C1=CC=CS1
Molecular Weight	184.22
Reaxy-Rn	5651
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5651&ln=

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.

12 results found

Lot Number	Certificate Type	Date	Item
E2316468	Certificate of Analysis	Mar 07, 2023	E331015
E2316437	Certificate of Analysis	Mar 07, 2023	E331015
E2316469	Certificate of Analysis	Mar 07, 2023	E331015
E2316457	Certificate of Analysis	Mar 07, 2023	E331015
C2317874	Certificate of Analysis	Feb 27, 2023	E331015
C2317909	Certificate of Analysis	Feb 27, 2023	E331015
C2317942	Certificate of Analysis	Feb 27, 2023	E331015
C2317930	Certificate of Analysis	Feb 27, 2023	E331015
C2317946	Certificate of Analysis	Feb 27, 2023	E331015
C2317910	Certificate of Analysis	Feb 27, 2023	E331015
C2317931	Certificate of Analysis	Feb 27, 2023	E331015
C2317928	Certificate of Analysis	Feb 27, 2023	E331015

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Chemical and Physical Properties

Solubility	Difficult to mix
Refractive Index	1.5505
Flash Point(°F)	230°F
Flash Point(°C)	>110°
Boil Point(°C)	102-110° C
Molecular Weight	184.210 g/mol
XLogP3	1.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	184.019 Da
Monoisotopic Mass	184.019 Da
Topological Polar Surface Area	71.600 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	191.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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