3-Butyl-1-(1-isopropyl-3-pyrrolidinyl)-1-phenyl-urea fumarate

Base Information

• Chemical Name: 3-Butyl-1-(1-isopropyl-3-pyrrolidinyl)-1-phenyl-urea fumarate
• CAS No.: 20070-54-6
• Molecular Formula: C22H33N3O5
• Molecular Weight: 419.519
• Mol file: 20070-54-6.mol

Synonyms:3-Butyl-1-(1-isopropyl-3-pyrrolidinyl)-1-phenyl-urea fumarate;Urea, 3-butyl-1-(1-isopropyl-3-pyrrolidinyl)-1-phenyl-, fumarate (1:1);20070-54-6;C18H29N3O.C4H4O4;C18-H29-N3-O.C4-H4-O4;LS-159258

Chemical Property of 3-Butyl-1-(1-isopropyl-3-pyrrolidinyl)-1-phenyl-urea fumarate

Chemical Property:

• Vapor Pressure: 1.39E-08mmHg at 25°C
• Boiling Point: 458.3°C at 760 mmHg
• Flash Point: 231°C
• PSA: 110.18000
• LogP: 3.52600
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 419.24202116
• Heavy Atom Count: 30
• Complexity: 458

Purity/Quality:

99% ^*data from raw suppliers

UREA, 3-BUTYL-1-(1-ISOPROPYL-3-PYRROLIDINYL)-1-PHENYL-, FUMARATE (1:1) 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCNC(=O)N(C1CCN(C1)C(C)C)C2=CC=CC=C2.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CCCCNC(=O)N(C1CCN(C1)C(C)C)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O

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