Dasotraline

Base Information

• Chemical Name: Dasotraline
• CAS No.: 675126-05-3
• Molecular Formula: C16H15Cl2N
• Molecular Weight: 292.20300
• UNII: 4D28EY0L5T
• DSSTox Substance ID: DTXSID20217855
• Nikkaji Number: J2.556.180E
• Wikipedia: Dasotraline
• Wikidata: Q27076989
• NCI Thesaurus Code: C166750
• Metabolomics Workbench ID: 153318
• ChEMBL ID: CHEMBL3301595
• Mol file: 675126-05-3.mol

Synonyms:4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-amine;dasotraline

Chemical Property of Dasotraline

Chemical Property:

• PSA: 26.02000
• LogP: 5.61920
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 291.0581549
• Heavy Atom Count: 19
• Complexity: 309

Purity/Quality:

99%, ^*data from raw suppliers

Dasotraline(SEP-225289)freebase >98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(C2=CC=CC=C2C1C3=CC(=C(C=C3)Cl)Cl)N
• Isomeric SMILES: C1C[C@H](C2=CC=CC=C2[C@@H]1C3=CC(=C(C=C3)Cl)Cl)N
• Recent ClinicalTrials: Dasotraline Pediatric ADHD Study

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