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2-(2-Chloroquinazolin-4-yl)acetamide - 95%, high purity , CAS No.425638-74-0

COA

Grade & Purity:

≥95%

Cas Number: 425638-74-0
Molecular Weight: 221.64
PubChem CID: 18770867

In stock

Item Number

C193371

Grouped product items
SKU	Size	Availability	Price	Qty
C193371-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$36.90
C193371-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$152.90

Basic Description

Synonyms	2-(2-Chloroquinazolin-4-yl)acetamide \| 425638-74-0 \| 2-(2-CHLOROQUINAZOLINE-4-YL)-ACETAMIDE \| DE-0070 \| SCHEMBL1991028 \| DTXSID30596143 \| HBENSHGDVIJNBK-UHFFFAOYSA-N \| AMY10671 \| MFCD16627975 \| 2-(2-chloro-4-quinazolinyl)acetamide \| AKOS015993906 \| SB17903 \| 2-(2-chloroquinazoli
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazanaphthalenes
    - Subclass Benzodiazines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazanaphthalenes
Subclass	Benzodiazines
Intermediate Tree Nodes	Not available
Direct Parent	Quinazolines
Alternative Parents	2-halopyrimidines Benzenoids Aryl chlorides Heteroaromatic compounds Primary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Quinazoline - 2-halopyrimidine - Halopyrimidine - Aryl chloride - Aryl halide - Pyrimidine - Benzenoid - Heteroaromatic compound - Carboxamide group - Primary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine 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	2-(2-chloroquinazolin-4-yl)acetamide
INCHI	InChI=1S/C10H8ClN3O/c11-10-13-7-4-2-1-3-6(7)8(14-10)5-9(12)15/h1-4H,5H2,(H2,12,15)
InChIKey	HBENSHGDVIJNBK-UHFFFAOYSA-N
Smiles	C1=CC=C2C(=C1)C(=NC(=N2)Cl)CC(=O)N
Isomeric SMILES	C1=CC=C2C(=C1)C(=NC(=N2)Cl)CC(=O)N
Molecular Weight	221.64
Reaxy-Rn	14087156
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14087156&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	221.640 g/mol
XLogP3	1.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	221.036 Da
Monoisotopic Mass	221.036 Da
Topological Polar Surface Area	68.900 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	249.000
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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