7-Bromo-1-chloroisoquinoline - ≥97% , CAS No.215453-51-3

CAS: 215453-51-3 Cat. No.: B133069 Molecular Weight: 242.5 Beilstein Registry Number: 8404252 EC Number: 681-895-0
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
SY009086 | DTXSID70424693 | A4632 | W-206647 | HMS1702A07 | AKOS000739365 | FT-0643981 | 7-Bromo-1-Chloroisoquinoline | 7-Bromo-1-chloro-isoquinoline, AldrichCPR | AM20050950 | SCHEMBL629963 | F8885-1673 | BCP26690 | ISOQUINOLINE, 7-BROMO-1-CHLORO- | UMSW
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
B133069-1g
3

$16.90

$25.90
Save $9.00 (34.75%)
5g
B133069-5g
4

$69.90

$104.90
Save $35.00 (33.37%)
10g
B133069-10g
5

$123.90

$185.90
Save $62.00 (33.35%)
25g
B133069-25g
4

$308.90

$463.90
Save $155.00 (33.41%)
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Application:

2-Formyl-3-thiopheneboronic acid can be used as:
A substrate in the palladium-Tedicyp catalyzed Suzuki coupling reaction with different aryl bromides.
A starting material for the synthesis of 4H-thieno[2,3-c]-isoquinolin-5-one derivatives as PARP-1 inhibitors.
A starting material for the preparation of phenanthro-dithiophene moieties having field-effect transistor properties.


Specifications

Synonyms
SY009086 | DTXSID70424693 | A4632 | W-206647 | HMS1702A07 | AKOS000739365 | FT-0643981 | 7-Bromo-1-Chloroisoquinoline | 7-Bromo-1-chloro-isoquinoline, AldrichCPR | AM20050950 | SCHEMBL629963 | F8885-1673 | BCP26690 | ISOQUINOLINE, 7-BROMO-1-CHLORO- | UMSW
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Pubchem Sid488195839
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488195839
Canonical SmilesC1=CC(=CC2=C1C=CN=C2Cl)Br
IUPAC Name7-bromo-1-chloroisoquinoline
InChIKeyUMSWWSIVPWVJOX-UHFFFAOYSA-N
INCHI1S/C9H5BrClN/c10-7-2-1-6-3-4-12-9(11)8(6)5-7/h1-5H
Isomeric SMILES C1=CC(=CC2=C1C=CN=C2Cl)Br
Molecular Weight 242.5
Beilstein 8404252
Reaxy-Rn 8404252
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8404252&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassIsoquinolines and derivatives
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentIsoquinolines and derivatives
Alternative Parents 2-halopyridines  Benzenoids  Aryl chlorides  Aryl bromides  Heteroaromatic compounds  Azacyclic compounds  Organonitrogen compounds  Organochlorides  Organobromides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Isoquinoline - 2-halopyridine - Aryl bromide - Aryl chloride - Aryl halide - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Organochloride - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
DescriptionThis 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
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

10 results found

Lot NumberCertificate TypeDateItem
J2523045Certificate of AnalysisOct 28, 2025 B133069
E1525070Certificate of AnalysisJun 16, 2025 B133069
G23111202Certificate of AnalysisApr 07, 2025 B133069
G23111206Certificate of AnalysisApr 07, 2025 B133069
G23111207Certificate of AnalysisApr 07, 2025 B133069
G23111217Certificate of AnalysisApr 07, 2025 B133069
G23111222Certificate of AnalysisApr 07, 2025 B133069
G23111227Certificate of AnalysisApr 07, 2025 B133069
G2311357Certificate of AnalysisApr 07, 2025 B133069
G23111357Certificate of AnalysisMay 12, 2023 B133069
Chemical and Physical Properties
Melt Point(°C)121-126°C
Molecular Weight242.500 g/mol
XLogP33.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass240.929 Da
Monoisotopic Mass240.929 Da
Topological Polar Surface Area12.900 Ų
Heavy Atom Count12
Formal Charge0
Complexity165.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
Reviews

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