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4-Chloro-7-methoxyquinazolin-6-yl acetate hydrochloride - 97%, high purity , CAS No.179688-54-1

COA

Grade & Purity:

≥97%

Cas Number: 179688-54-1
Molecular Weight: 289.12
PubChem CID: 22022159

In stock

Item Number

C191631

Grouped product items
SKU	Size	Availability	Price
C191631-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$16.90
C191631-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$70.90
C191631-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$252.90

Discover 4-Chloro-7-methoxyquinazolin-6-yl acetate hydrochloride by Aladdin Scientific in 97% for only $16.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	179688-54-1 \| 4-Chloro-7-methoxyquinazolin-6-yl acetate hydrochloride \| 4-Chloro-6-acetoxy-7-methoxyquinazoline hydrochloride \| 4-chloro-7-methoxyquinazolin-6-yl acetate HCL \| 4-chloro-7-methoxy-quinazolin-6-yl acetate hydrochloride \| (4-chloro-7-methoxyquinazolin-
Specifications & Purity	≥97%
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	Anisoles Halopyrimidines Alkyl aryl ethers Aryl chlorides Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Quinazoline - Anisole - Alkyl aryl ether - Halopyrimidine - Aryl chloride - Aryl halide - Pyrimidine - Benzenoid - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Ether - Azacycle - Monocarboxylic acid or derivatives - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrochloride - 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-chloro-7-methoxyquinazolin-6-yl) acetate;hydrochloride
INCHI	InChI=1S/C11H9ClN2O3.ClH/c1-6(15)17-10-3-7-8(4-9(10)16-2)13-5-14-11(7)12;/h3-5H,1-2H3;1H
InChIKey	DSYIUUXIRMLRQU-UHFFFAOYSA-N
Smiles	CC(=O)OC1=C(C=C2C(=C1)C(=NC=N2)Cl)OC.Cl
Isomeric SMILES	CC(=O)OC1=C(C=C2C(=C1)C(=NC=N2)Cl)OC.Cl
Molecular Weight	289.12
Reaxy-Rn	10385191
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10385191&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	289.110 g/mol
XLogP3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	288.007 Da
Monoisotopic Mass	288.007 Da
Topological Polar Surface Area	61.300 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	290.000
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	2

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