1-Chloro-6-methoxyisoquinoline - ≥97% , CAS No.132997-77-4

CAS: 132997-77-4 Cat. No.: C586997 Molecular Weight: 193.63
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
MFCD06738659 | J-504523 | AKOS005256822 | AB27579 | 1 -chloro-6 methoxy isoquinoline | AM20120437 | Isoquinoline, 1-chloro-6-methoxy- | SY003965 | EN300-181475 | 1-Chloro-6-methoxyisoquinoline | 1-CHLORO-6-METHOXY-ISOQUINOLINE | 1-Chloro-6methoxy-isoquino
Storage
Store at 2-8°C,Desiccated
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
250mg
C586997-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$22.90
1g
C586997-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$52.90

$73.90
Save $21.00 (28.42%)
5g
C586997-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$245.90

$349.90
Save $104.00 (29.72%)
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Why this grade

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

🌡

Storage & shipping

Store at 2-8°C,Desiccated Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

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

Specifications

Synonyms
MFCD06738659 | J-504523 | AKOS005256822 | AB27579 | 1 -chloro-6 methoxy isoquinoline | AM20120437 | Isoquinoline, 1-chloro-6-methoxy- | SY003965 | EN300-181475 | 1-Chloro-6-methoxyisoquinoline | 1-CHLORO-6-METHOXY-ISOQUINOLINE | 1-Chloro-6methoxy-isoquino
Specifications & Purity
≥97%
Storage
Store at 2-8°C, Desiccated
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥97%
Names and Identifiers
Canonical SmilesCOC1=CC2=C(C=C1)C(=NC=C2)Cl
IUPAC Name1-chloro-6-methoxyisoquinoline
InChIKeyUTZJYSXOFHCSGZ-UHFFFAOYSA-N
INCHI1S/C10H8ClNO/c1-13-8-2-3-9-7(6-8)4-5-12-10(9)11/h2-6H,1H3
Isomeric SMILES COC1=CC2=C(C=C1)C(=NC=C2)Cl
Molecular Weight 193.63
Reaxy-Rn 132672
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=132672&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.

Look up COA →

📊 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 Anisoles  Alkyl aryl ethers  2-halopyridines  Aryl chlorides  Heteroaromatic compounds  Azacyclic compounds  Organonitrogen compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Isoquinoline - Anisole - Phenol ether - Alkyl aryl ether - 2-halopyridine - Aryl chloride - Aryl halide - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Ether - Organohalogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - 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.

3 results found

Lot NumberCertificate TypeDateItem
L2504213Certificate of AnalysisOct 11, 2025 C586997
L2504214Certificate of AnalysisOct 11, 2025 C586997
L2516655Certificate of AnalysisOct 11, 2025 C586997
Chemical and Physical Properties
SensitivityMoisture Sensitive
Molecular Weight193.630 g/mol
XLogP33.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass193.029 Da
Monoisotopic Mass193.029 Da
Topological Polar Surface Area22.100 Ų
Heavy Atom Count13
Formal Charge0
Complexity176.000
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
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