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ethanedicarbonimidoyl dicyanide - ≥98%, high purity , CAS No.28321-79-1

COA

Grade & Purity:

≥98%

Cas Number: 28321-79-1
Molecular Weight: 106.08
PubChem CID: 119924

In stock

Item Number

E770769

Grouped product items
SKU	Size	Availability	Price
E770769-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$222.90
E770769-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$780.90
E770769-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,813.90
E770769-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$11,050.90

Basic Description

Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Imines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Imines
Intermediate Tree Nodes	Not available
Direct Parent	Ketimines
Alternative Parents	Nitriles Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic acyclic compounds
Substituents	Ketimine - Nitrile - Carbonitrile - Organopnictogen compound - Hydrocarbon derivative - Carbonyl group - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as ketimines. These are organic compounds bearing the ketimine functional group, with the general structure R2C=NR' ( R is not a hydrogen ).
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

INCHI	InChI=1S/C4H2N4/c5-1-3(7)4(8)2-6/h7-8H
InChIKey	JUFLTGRGLUCRCU-UHFFFAOYSA-N
Smiles	C(#N)C(=N)C(=N)C#N
Isomeric SMILES	C(#N)C(=N)C(=N)C#N
Molecular Weight	106.08

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

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

Analytical Chart:

Chemical and Physical Properties

Melt Point(°C)	165-166 °C (lit.)
Molecular Weight	106.090 g/mol
XLogP3	0.100
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	106.028 Da
Monoisotopic Mass	106.028 Da
Topological Polar Surface Area	95.300 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	193.000
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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