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Ethyl 2-pyrimidinecarboxylate - 98%, high purity , CAS No.42839-08-7

COA

Grade & Purity:

≥98%

Cas Number: 42839-08-7
Molecular Weight: 152.2
PubChem CID: 13360715
PubChem SID: 488198418

In stock

Item Number

E184499

Grouped product items
SKU	Size	Availability	Price
E184499-1g	1g	5	$11.90
E184499-5g	5g	5	$39.90
E184499-10g	10g	4	$70.90
E184499-25g	25g	3	$128.90

Discover Ethyl 2-pyrimidinecarboxylate by Aladdin Scientific in 98% for only $11.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	Ethyl 2-pyrimidinecarboxylate \| 42839-08-7 \| Ethyl Pyrimidine-2-carboxylate \| 2-Pyrimidinecarboxylic acid, ethyl ester \| MFCD12197317 \| ethoxycarbonylpyrimidine \| pyrimidine-2-carboxylic acid ethyl ester \| 2-PYRIMIDINECARBOXYLIC ACID ETHYL ESTER \| ethyl pyrimidin-2-carbo
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazines
    - Subclass Pyrimidines and pyrimidine derivatives
      - Level5 Pyrimidinecarboxylic acids and derivatives
        Level6 Pyrimidinecarboxylic acids

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazines
Subclass	Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes	Pyrimidinecarboxylic acids and derivatives
Direct Parent	Pyrimidinecarboxylic acids
Alternative Parents	Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Pyrimidine-2-carboxylic acid - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids. These are pyrimidines with a structure containing a carboxyl group attached to the pyrimidine ring.
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	488198418
IUPAC Name	ethyl pyrimidine-2-carboxylate
INCHI	InChI=1S/C7H8N2O2/c1-2-11-7(10)6-8-4-3-5-9-6/h3-5H,2H2,1H3
InChIKey	PYFMAAFCQDFHJX-UHFFFAOYSA-N
Smiles	CCOC(=O)C1=NC=CC=N1
Isomeric SMILES	CCOC(=O)C1=NC=CC=N1
Molecular Weight	152.2
Reaxy-Rn	511104
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=511104&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
K1921085	Certificate of Analysis	Sep 07, 2023	E184499
L2213440	Certificate of Analysis	Nov 25, 2022	E184499
L2213293	Certificate of Analysis	Nov 25, 2022	E184499
L2213292	Certificate of Analysis	Nov 25, 2022	E184499
L2213328	Certificate of Analysis	Nov 25, 2022	E184499
L2213315	Certificate of Analysis	Nov 25, 2022	E184499
L2213287	Certificate of Analysis	Nov 25, 2022	E184499

Chemical and Physical Properties

Molecular Weight	152.150 g/mol
XLogP3	-0.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	152.059 Da
Monoisotopic Mass	152.059 Da
Topological Polar Surface Area	52.100 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	132.000
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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