3-Chloro-6-methoxyisoquinoline

Base Information

• Chemical Name: 3-Chloro-6-methoxyisoquinoline
• CAS No.: 82117-20-2
• Molecular Formula: C10H8 Cl N O
• Molecular Weight: 193.63
• Hs Code.: 2933499090
• European Community (EC) Number: 813-819-0
• DSSTox Substance ID: DTXSID50696033
• Wikidata: Q82625448
• Mol file: 82117-20-2.mol

Synonyms:3-Chloro-6-methoxyisoquinoline;82117-20-2;3-CHLORO-6-METHOXY-ISOQUINOLINE;MFCD11044725;SCHEMBL18769997;DTXSID50696033;AKOS006309172;SB38874;SY221785;CS-0141286;EN300-364409

Chemical Property of 3-Chloro-6-methoxyisoquinoline

Chemical Property:

• PSA: 22.12000
• LogP: 2.89680
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 193.0294416
• Heavy Atom Count: 13
• Complexity: 176

Purity/Quality:

99%min ^*data from raw suppliers

3-chloro-6-methoxyisoquinoline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=CC(=NC=C2C=C1)Cl