7-chloro-6-fluoro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine

Base Information

• Chemical Name: 7-chloro-6-fluoro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine
• CAS No.: 824430-69-5
• Molecular Formula: C11H13ClFN
• ChEMBL ID: CHEMBL368016
• DSSTox Substance ID: DTXSID60460505
• Pharos Ligand ID: BA7FB1VC8QL2

Synonyms:CHEMBL368016;824430-69-5;7-chloro-6-fluoro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine;SCHEMBL3290263;DTXSID60460505;LSYBMYCVSJZAMI-UHFFFAOYSA-N;BDBM50161639;L023572;(1R,S)-8-chloro-9-fluoro-2,3,4,5-tetrahydro-1-methyl-1H-3-;8-Chloro-9-fluoro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine;8-Chloro-9-fluoro-1-methyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine

Chemical Property of 7-chloro-6-fluoro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 213.0720553
• Heavy Atom Count: 14
• Complexity: 200

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CNCCC2=C1C(=C(C=C2)Cl)F

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