1-Butyl-3-[4-[[4-(butylcarbamoylamino)phenyl]methyl]phenyl]urea

Base Information

• Chemical Name: 1-Butyl-3-[4-[[4-(butylcarbamoylamino)phenyl]methyl]phenyl]urea
• CAS No.: 77703-56-1
• Molecular Formula: C23H32 N4 O2
• Molecular Weight: 396.53
• European Community (EC) Number: 667-459-2
• DSSTox Substance ID: DTXSID501329822
• Nikkaji Number: J428.758D
• Mol file: 77703-56-1.mol

Synonyms:4,4'-METHYLENEBIS(1-BUTYL-3-PHENYLUREA);1-butyl-3-[4-[[4-(butylcarbamoylamino)phenyl]methyl]phenyl]urea;77703-56-1;1,1'-(Methylenebis(4,1-phenylene))bis(3-butylurea);1,1'-[Methylenebis(4,1-phenylene)]bis(3-butylurea);SCHEMBL10599703;DTXSID501329822;AKOS024431038;EC 416-600-4;Methylene-bis-4,1-(N-phenylene-N'-butylurea);Urea, N,N''-(methylenedi-4,1-phenylene)bis[N'-butyl-

Chemical Property of 1-Butyl-3-[4-[[4-(butylcarbamoylamino)phenyl]methyl]phenyl]urea

Chemical Property:

• Boiling Point: 527.0±50.0 °C(Predicted)
• PKA: 13.90±0.46(Predicted)
• PSA: 0.00000
• Density: 1.127±0.06 g/cm3(Predicted)
• LogP: 0.00000
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 396.25252628
• Heavy Atom Count: 29
• Complexity: 428

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCNC(=O)NC1=CC=C(C=C1)CC2=CC=C(C=C2)NC(=O)NCCCC