1-(4-Amino-3,5-dichloro-phenyl)-2-tert-butyl-d9-amino-ethanone

Base Information

• Chemical Name: 1-(4-Amino-3,5-dichloro-phenyl)-2-tert-butyl-d9-amino-ethanone
• CAS No.: 129138-59-6
• Molecular Formula: C12H7D9Cl2N2O
• Molecular Weight: 284.229
• DSSTox Substance ID: DTXSID90443205
• Wikidata: Q82260923
• Mol file: 129138-59-6.mol

Synonyms:129138-59-6;1-(4-Amino-3,5-dichloro-phenyl)-2-tert-butyl-d9-amino-ethanone;1-(4-amino-3,5-dichlorophenyl)-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]ethanone;Keto Clenbuterol-d9;Ethanone, 1-(4-amino-3,5-dichlorophenyl)-2-[[1,1-di(methyl-d3)ethyl-2,2,2-d3]amino]- (9CI);DTXSID90443205;CS-T-47743;J-005655

Chemical Property of 1-(4-Amino-3,5-dichloro-phenyl)-2-tert-butyl-d9-amino-ethanone

Chemical Property:

• Appearance/Colour: Yellow solid
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.566
• Boiling Point: 415.853 °C at 760 mmHg
• Flash Point: 205.301 °C
• PSA: 55.12000
• Density: 1.28 g/cm³
• LogP: 4.11850
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 283.1204592
• Heavy Atom Count: 17
• Complexity: 266

Purity/Quality:

99% ^*data from raw suppliers

1-(4-Amino-3,5-dichloro-phenyl)-2-tert-butyl-d9-aminoethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)NCC(=O)C1=CC(=C(C(=C1)Cl)N)Cl
• Isomeric SMILES: [2H]C([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])NCC(=O)C1=CC(=C(C(=C1)Cl)N)Cl