6-Chloro-2-(2,4-dichloro-phenyl)-1,2,3,4-tetrahydro-isoquinoline-1-carboxylic acid

Base Information

• Chemical Name: 6-Chloro-2-(2,4-dichloro-phenyl)-1,2,3,4-tetrahydro-isoquinoline-1-carboxylic acid
• CAS No.: 1260637-75-9
• Molecular Formula: C16H12Cl3NO2
• Molecular Weight: 356.6
• DSSTox Substance ID: DTXSID001131414
• Mol file: 1260637-75-9.mol

Synonyms:6-CHLORO-2-(2,4-DICHLORO-PHENYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-1-CARBOXYLIC ACID;1260637-75-9;6-chloro-2-(2,4-dichlorophenyl)-3,4-dihydro-1H-isoquinoline-1-carboxylic acid;DTXSID001131414;1-Isoquinolinecarboxylic acid, 6-chloro-2-(2,4-dichlorophenyl)-1,2,3,4-tetrahydro-;6-Chloro-2-(2,4-dichlorophenyl)-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid;6-Chloro-2-(2,4-dichlorophenyl)-1,2,3,4-tetrahydroisoquinoline-1-carboxylicacid

Chemical Property of 6-Chloro-2-(2,4-dichloro-phenyl)-1,2,3,4-tetrahydro-isoquinoline-1-carboxylic acid

Chemical Property:

• PKA: 3.48±0.20(Predicted)
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 354.993362
• Heavy Atom Count: 22
• Complexity: 422

Purity/Quality:

99% ^*data from raw suppliers

6-CHLORO-2-(2,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-1-CARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1CN(C(C2=C1C=C(C=C2)Cl)C(=O)O)C3=C(C=C(C=C3)Cl)Cl