(E)-but-2-enedioic acid;N-[4-[2-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]ethynyl]phenyl]formamide

Base Information

• Chemical Name: (E)-but-2-enedioic acid;N-[4-[2-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]ethynyl]phenyl]formamide
• CAS No.: 126661-34-5
• Molecular Formula: C26H30N2O7
• Molecular Weight: 482.5256
• Mol file: 126661-34-5.mol

Synonyms:126661-34-5;Formamide, N-(4-((2-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)ethynyl)phenyl)-, (E)-2-butenedioate (1:1)(salt)

Chemical Property of (E)-but-2-enedioic acid;N-[4-[2-[2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]ethynyl]phenyl]formamide

Chemical Property:

• Vapor Pressure: 3.43E-15mmHg at 25°C
• Boiling Point: 598.9°Cat760mmHg
• Flash Point: 316°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 11
• Exact Mass: 482.20530130
• Heavy Atom Count: 35
• Complexity: 628

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)NCC(COC1=CC=CC=C1C#CC2=CC=C(C=C2)NC=O)O.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CC(C)(C)NCC(COC1=CC=CC=C1C#CC2=CC=C(C=C2)NC=O)O.C(=C/C(=O)O)\C(=O)O