6-Chloro-7-methoxy-1-methyl-9H-beta-carboline

Base Information

• Chemical Name: 6-Chloro-7-methoxy-1-methyl-9H-beta-carboline
• CAS No.: 606928-38-5
• Molecular Formula: C13H11ClN2O
• Molecular Weight: 246.69200
• DSSTox Substance ID: DTXSID60450547
• Nikkaji Number: J1.922.928I
• Mol file: 606928-38-5.mol

Synonyms:606928-38-5;6-Chloro-7-methoxy-1-methyl-9H-beta-carboline;6-chloroharmine;SADZEFVTUDJBOP-UHFFFAOYSA-;DTXSID60450547;1-Methyl-6-chloro-7-methoxy-beta-carboline;InChI=1/C13H11ClN2O/c1-7-13-8(3-4-15-7)9-5-10(14)12(17-2)6-11(9)16-13/h3-6,16H,1-2H3

Chemical Property of 6-Chloro-7-methoxy-1-methyl-9H-beta-carboline

Chemical Property:

• PSA: 37.91000
• LogP: 3.68650
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 246.0559907
• Heavy Atom Count: 17
• Complexity: 289

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC=CC2=C1NC3=CC(=C(C=C23)Cl)OC