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4-Bromo-1-chloroisoquinoline - 98%, high purity , CAS No.66728-98-1

COA

Grade & Purity:

≥98%

Cas Number: 66728-98-1
Molecular Weight: 242.5
PubChem CID: 459766
PubChem SID: 488189911

In stock

Item Number

B185912

Grouped product items
SKU	Size	Availability	Price
B185912-100mg	100mg	3	$9.90
B185912-250mg	250mg	3	$13.90
B185912-1g	1g	7	$45.90
B185912-5g	5g	5	$175.90
B185912-25g	25g	2	$789.90

Discover 4-Bromo-1-chloroisoquinoline by Aladdin Scientific in 98% for only $9.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	4-Bromo-1-chloroisoquinoline \| 66728-98-1 \| 4-bromo-1-chloro-isoquinoline \| 1-chloro-4-bromoisoquinoline \| MFCD00234469 \| Isoquinoline, 4-bromo-1-chloro- \| 4-bromo-1 chloroisoquinoline \| 1-chloro-4-bromo-isoquinoline \| SCHEMBL1396177 \| DTXSID40332695 \| HRWILRGBDZGABZ-UHFFFAO
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Isoquinolines and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Isoquinolines and derivatives
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Isoquinolines and derivatives
Alternative Parents	Polyhalopyridines 2-halopyridines Benzenoids Aryl chlorides Aryl bromides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Isoquinoline - Polyhalopyridine - 2-halopyridine - Aryl bromide - Aryl chloride - Aryl halide - Pyridine - Benzenoid - Heteroaromatic compound - Azacycle - Organonitrogen compound - Organochloride - Organobromide - Organohalogen compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.
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

Pubchem Sid	488189911
IUPAC Name	4-bromo-1-chloroisoquinoline
INCHI	InChI=1S/C9H5BrClN/c10-8-5-12-9(11)7-4-2-1-3-6(7)8/h1-5H
InChIKey	HRWILRGBDZGABZ-UHFFFAOYSA-N
Smiles	C1=CC=C2C(=C1)C(=CN=C2Cl)Br
Isomeric SMILES	C1=CC=C2C(=C1)C(=CN=C2Cl)Br
Molecular Weight	242.5
Reaxy-Rn	128821
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=128821&ln=

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

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

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10 results found

Lot Number	Certificate Type	Date	Item
G2310723	Certificate of Analysis	Jun 17, 2023	B185912
G2310811	Certificate of Analysis	Jun 17, 2023	B185912
G2310731	Certificate of Analysis	Jun 17, 2023	B185912
G2310729	Certificate of Analysis	Jun 17, 2023	B185912
G2310728	Certificate of Analysis	Jun 17, 2023	B185912
G2310727	Certificate of Analysis	Jun 17, 2023	B185912
G2310745	Certificate of Analysis	Jun 17, 2023	B185912
G2310726	Certificate of Analysis	Jun 17, 2023	B185912
G2310725	Certificate of Analysis	Jun 17, 2023	B185912
G2310724	Certificate of Analysis	Jun 17, 2023	B185912

Chemical and Physical Properties

Molecular Weight	242.500 g/mol
XLogP3	3.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	240.929 Da
Monoisotopic Mass	240.929 Da
Topological Polar Surface Area	12.900 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	165.000
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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