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4-chloroquinazoline-6-carbonitrile - 97%, high purity , CAS No.150449-97-1

COA

Grade & Purity:

≥97%

Cas Number: 150449-97-1
Molecular Weight: 189.6
PubChem CID: 10012727

In stock

Item Number

C174364

Grouped product items
SKU	Size	Availability	Price
C174364-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$62.90
C174364-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$206.90
C174364-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$930.90

Discover 4-chloroquinazoline-6-carbonitrile by Aladdin Scientific in 97% for only $62.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	4-chloroquinazoline-6-carbonitrile \| 150449-97-1 \| 6-QUINAZOLINECARBONITRILE, 4-CHLORO- \| MFCD10697147 \| 4-Chloro-6-cyanoquinazoline \| SCHEMBL5766404 \| DTXSID70434116 \| PQJUTOVJNYMGFX-UHFFFAOYSA-N \| AMY23530 \| AKOS006305779 \| CS-W022166 \| DS-2136 \| PB23812 \| SY031672 \| FT-0685872 \| EN
Specifications & Purity	≥97%
Storage Temp	Room temperature
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	Halopyrimidines Benzenoids Aryl chlorides Heteroaromatic compounds Nitriles Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Quinazoline - Halopyrimidine - Aryl chloride - Aryl halide - Pyrimidine - Benzenoid - Heteroaromatic compound - Carbonitrile - Nitrile - Azacycle - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Cyanide - 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	4-chloroquinazoline-6-carbonitrile
INCHI	InChI=1S/C9H4ClN3/c10-9-7-3-6(4-11)1-2-8(7)12-5-13-9/h1-3,5H
InChIKey	PQJUTOVJNYMGFX-UHFFFAOYSA-N
Smiles	C1=CC2=C(C=C1C#N)C(=NC=N2)Cl
Isomeric SMILES	C1=CC2=C(C=C1C#N)C(=NC=N2)Cl
Molecular Weight	189.6
Reaxy-Rn	7022174
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7022174&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	189.600 g/mol
XLogP3	2.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	189.009 Da
Monoisotopic Mass	189.009 Da
Topological Polar Surface Area	49.600 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	234.000
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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