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azetidin-1-yl-(5-chloropyrazin-2-yl)methanone - 97%, high purity , CAS No.915948-98-0

COA

Grade & Purity:

≥97%

Cas Number: 915948-98-0
Molecular Weight: 197.62
PubChem CID: 46870328

In stock

Item Number

A635108

Grouped product items
SKU	Size	Availability	Price
A635108-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$162.90
A635108-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$259.90
A635108-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$433.90
A635108-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$649.90
A635108-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,251.90

Basic Description

Synonyms	SCHEMBL320648 \| DTXSID90676990 \| SB52129 \| 2-(azetidin-1-ylcarbonyl)-5-chloropyrazine \| (Azetidin-1-yl)(5-chloropyrazin-2-yl)methanone \| SY323136 \| azetidin-1-yl-(5-chloropyrazin-2-yl)methanone \| Azetidin-1-yl(5-chloropyrazin-2-yl)methanone \| Azetidin-1-y
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazines
    - Subclass Pyrazines
      - Level5 Pyrazine carboxylic acids and derivatives
        Level6 Pyrazinecarboxamides

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazines
Subclass	Pyrazines
Intermediate Tree Nodes	Pyrazine carboxylic acids and derivatives
Direct Parent	Pyrazinecarboxamides
Alternative Parents	2-heteroaryl carboxamides Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Azetidines Amino acids and derivatives Azacyclic compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Pyrazinecarboxamide - 2-heteroaryl carboxamide - Aryl chloride - Aryl halide - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Azetidine - Carboxamide group - Tertiary amine - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as pyrazinecarboxamides. These are compounds containing a pyrazine ring which bears a carboxamide.
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	azetidin-1-yl-(5-chloropyrazin-2-yl)methanone
INCHI	InChI=1S/C8H8ClN3O/c9-7-5-10-6(4-11-7)8(13)12-2-1-3-12/h4-5H,1-3H2
InChIKey	WIFSSWYPPHSSIV-UHFFFAOYSA-N
Smiles	C1CN(C1)C(=O)C2=CN=C(C=N2)Cl
Isomeric SMILES	C1CN(C1)C(=O)C2=CN=C(C=N2)Cl
Alternate CAS	915948-98-0
PubChem CID	46870328
Molecular Weight	197.62

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	197.620 g/mol
XLogP3	0.700
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	197.036 Da
Monoisotopic Mass	197.036 Da
Topological Polar Surface Area	46.100 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	208.000
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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