2-[2-[(1R,2R)-1-(5-tert-butyl-2-methoxyphenyl)-2-(dimethylamino)-1-hydroxypropyl]phenoxy]acetamide

Base Information

• Chemical Name: 2-[2-[(1R,2R)-1-(5-tert-butyl-2-methoxyphenyl)-2-(dimethylamino)-1-hydroxypropyl]phenoxy]acetamide
• CAS No.: 138779-29-0
• Molecular Formula: C24H34N2O4
• Molecular Weight: 414.5378
• DSSTox Substance ID: DTXSID60930218
• Wikidata: Q82905471

Synonyms:(2-(2-dimethylamino-1-hydroxy-1-(2-methoxy-5-(1,1-dimethylethyl)phenyl)propyl)phenoxy)acetamide;ICI 181037;ICI-181,037;Zeneca ZM 181037;Zeneca ZM-181,037;Zeneca ZM-181037;Zeneca ZM181,037;ZM 181037;ZM-181037

Chemical Property of 2-[2-[(1R,2R)-1-(5-tert-butyl-2-methoxyphenyl)-2-(dimethylamino)-1-hydroxypropyl]phenoxy]acetamide

Chemical Property:

• Vapor Pressure: 7.43E-16mmHg at 25°C
• Boiling Point: 612.5°C at 760 mmHg
• Flash Point: 324.2°C
• Density: 1.111g/cm³
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 414.25185757
• Heavy Atom Count: 30
• Complexity: 562

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(C1=CC=CC=C1OCC(=O)N)(C2=C(C=CC(=C2)C(C)(C)C)OC)O)N(C)C
• Isomeric SMILES: C[C@H]([C@@](C1=CC=CC=C1OCC(=O)N)(C2=C(C=CC(=C2)C(C)(C)C)OC)O)N(C)C

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