3,6-Dimethylisoquinoline

Base Information

• Chemical Name: 3,6-Dimethylisoquinoline
• CAS No.: 102878-58-0
• Molecular Formula: C11H11N
• Molecular Weight: 157.21
• European Community (EC) Number: 836-664-0
• Mol file: 102878-58-0.mol

Synonyms:3,6-Dimethylisoquinoline;102878-58-0;Isoquinoline, 3,6-dimethyl- (6CI,9CI);SCHEMBL6845000;CEA87858;AKOS006373884;EN300-6764833

Chemical Property of 3,6-Dimethylisoquinoline

Chemical Property:

• Melting Point: 193-195 °C (decomp)
• Boiling Point: 273.7±9.0 °C(Predicted)
• PKA: 6.12±0.38(Predicted)
• PSA: 12.89000
• Density: 1.052±0.06 g/cm3(Predicted)
• LogP: 2.85160
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 157.089149355
• Heavy Atom Count: 12
• Complexity: 155

Purity/Quality:

99% ^*data from raw suppliers

3,6-dimethyl-Isoquinoline 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)C=NC(=C2)C