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7-Chloroquinoline-2,3-dicarboxylic acid diethyl ester - 97%, high purity , CAS No.892874-55-4

COA

Grade & Purity:

≥97%

Cas Number: 892874-55-4
Molecular Weight: 307.73
PubChem CID: 17039604

In stock

Item Number

C335981

Grouped product items
SKU	Size	Availability	Price	Qty
C335981-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$275.90
C335981-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$89.90

Discover 7-Chloroquinoline-2,3-dicarboxylic acid diethyl ester by Aladdin Scientific in 97% for only $89.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	7-Chloroquinoline-2,3-dicarboxylic acid diethyl ester \| Diethyl 7-chloro-2,3-quinolinedicarboxylate \| FT-0726435 \| MFCD08437570 \| DTXSID40588877 \| 7-Chloroquinoline-2,3-dicarboxylic acid diethyl ester, AldrichCPR \| AB45113 \| diethyl 7-chloroquinoline-2,3-
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Quinolines and derivatives
    - Subclass Haloquinolines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Quinolines and derivatives
Subclass	Haloquinolines
Intermediate Tree Nodes	Not available
Direct Parent	Chloroquinolines
Alternative Parents	Pyridinecarboxylic acids Dicarboxylic acids and derivatives Benzenoids Aryl chlorides Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Chloroquinoline - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Pyridine - Benzenoid - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as chloroquinolines. These are compounds containing a quinoline moiety, which carries one or more chlorine atoms.
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

IUPAC Name	diethyl 7-chloroquinoline-2,3-dicarboxylate
INCHI	InChI=1S/C15H14ClNO4/c1-3-20-14(18)11-7-9-5-6-10(16)8-12(9)17-13(11)15(19)21-4-2/h5-8H,3-4H2,1-2H3
InChIKey	JQWWQBNHGCCJHZ-UHFFFAOYSA-N
Smiles	CCOC(=O)C1=C(N=C2C=C(C=CC2=C1)Cl)C(=O)OCC
Isomeric SMILES	CCOC(=O)C1=C(N=C2C=C(C=CC2=C1)Cl)C(=O)OCC
WGK Germany	3
PubChem CID	17039604
Molecular Weight	307.73

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	307.730 g/mol
XLogP3	3.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	307.061 Da
Monoisotopic Mass	307.061 Da
Topological Polar Surface Area	65.500 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	390.000
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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