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4-(2-Methoxyethoxy)benzonitrile - 98%, high purity , CAS No.80407-66-5

COA

Grade & Purity:

≥98%

Cas Number: 80407-66-5
Molecular Weight: 177.2
PubChem CID: 11217559

In stock

Item Number

M186698

Grouped product items
SKU	Size	Availability	Price	Qty
M186698-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,132.90

Discover 4-(2-Methoxyethoxy)benzonitrile by Aladdin Scientific in 98% for only $1,132.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	4-(2-methoxyethoxy)benzonitrile \| 80407-66-5 \| SCHEMBL4867346 \| DTXSID60459015 \| MFCD09907643 \| AKOS000192014 \| BS-24444 \| AM20041191 \| FT-0712298 \| EN300-74276 \| Z167839000
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenol ethers

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenol ethers
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenol ethers
Alternative Parents	Phenoxy compounds Benzonitriles Alkyl aryl ethers Nitriles Dialkyl ethers Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenoxy compound - Benzonitrile - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Dialkyl ether - Ether - Carbonitrile - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Cyanide - Organic oxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene 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

IUPAC Name	4-(2-methoxyethoxy)benzonitrile
INCHI	InChI=1S/C10H11NO2/c1-12-6-7-13-10-4-2-9(8-11)3-5-10/h2-5H,6-7H2,1H3
InChIKey	SISNRWJOVBGIJH-UHFFFAOYSA-N
Smiles	COCCOC1=CC=C(C=C1)C#N
Isomeric SMILES	COCCOC1=CC=C(C=C1)C#N
Molecular Weight	177.2
Reaxy-Rn	3269758
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3269758&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	177.200 g/mol
XLogP3	1.400
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	177.079 Da
Monoisotopic Mass	177.079 Da
Topological Polar Surface Area	42.300 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	177.000
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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