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2-Chloro-4-methoxypyrimidine-5-carbonitrile - 98%, high purity , CAS No.1106295-93-5

COA

Grade & Purity:

≥98%

Cas Number: 1106295-93-5
Molecular Weight: 169.6
PubChem CID: 22326771

In stock

Item Number

C179401

Grouped product items
SKU	Size	Availability	Price
C179401-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$306.90
C179401-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,160.90
C179401-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$4,660.90

Discover 2-Chloro-4-methoxypyrimidine-5-carbonitrile by Aladdin Scientific in 98% for only $306.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2-Chloro-4-methoxypyrimidine-5-carbonitrile \| 1106295-93-5 \| 2-Chloro-4-methoxy-pyrimidine-5-carbonitrile \| SCHEMBL2527306 \| DTXSID70624838 \| YIGFAXAWUVBGGI-UHFFFAOYSA-N \| MFCD16250650 \| AKOS015920113 \| CS-W000787 \| GS-6436 \| SB57320 \| FT-0706410 \| H10312 \| A894870
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Ethers

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Ethers
Intermediate Tree Nodes	Not available
Direct Parent	Alkyl aryl ethers
Alternative Parents	2-halopyrimidines Aryl chlorides Heteroaromatic compounds Nitriles Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Alkyl aryl ether - 2-halopyrimidine - Halopyrimidine - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Azacycle - Nitrile - Carbonitrile - Organoheterocyclic compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Cyanide - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl 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

IUPAC Name	2-chloro-4-methoxypyrimidine-5-carbonitrile
INCHI	InChI=1S/C6H4ClN3O/c1-11-5-4(2-8)3-9-6(7)10-5/h3H,1H3
InChIKey	YIGFAXAWUVBGGI-UHFFFAOYSA-N
Smiles	COC1=NC(=NC=C1C#N)Cl
Isomeric SMILES	COC1=NC(=NC=C1C#N)Cl
Molecular Weight	169.6
Reaxy-Rn	28723259
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=28723259&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	169.570 g/mol
XLogP3	1.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	169.004 Da
Monoisotopic Mass	169.004 Da
Topological Polar Surface Area	58.800 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	178.000
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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