1-(6,7-Dihydro-5H-benzocyclohepten-7-yl)pyrrolidine (E)-2-butenedioate (2:1)

Base Information

• Chemical Name: 1-(6,7-Dihydro-5H-benzocyclohepten-7-yl)pyrrolidine (E)-2-butenedioate (2:1)
• CAS No.: 62819-73-2
• Molecular Formula: C34H42N2O4
• Molecular Weight: 542.7083

Synonyms:1-(6,7-Dihydro-5H-benzocyclohepten-7-yl)pyrrolidine (E)-2-butenedioate (2:1);Di-(7-pyrrolidin-1-yl) 6,7-dihydro-5H-benzocycloheptene fumarate [French];Pyrrolidine, 1-(6,7-dihydro-5H-benzocyclohepten-7-yl)-, (E)-2-butenedioate (2:1);Di-(7-pyrrolidin-1-yl) 6,7-dihydro-5H-benzocycloheptene fumarate;62819-73-2;SCHEMBL11628354;SCHEMBL11628356;C30H38N2.C4H4O4;C30-H38-N2.C4-H4-O4;LS-137569

Chemical Property of 1-(6,7-Dihydro-5H-benzocyclohepten-7-yl)pyrrolidine (E)-2-butenedioate (2:1)

Chemical Property:

• Vapor Pressure: 0.000123mmHg at 25°C
• Boiling Point: 335.1°Cat760mmHg
• Flash Point: 141.9°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 542.31445783
• Heavy Atom Count: 40
• Complexity: 371

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(C1)C2CCC3=CC=CC=C3C=C2.C1CCN(C1)C2CCC3=CC=CC=C3C=C2.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: C1CCN(C1)C2CCC3=CC=CC=C3C=C2.C1CCN(C1)C2CCC3=CC=CC=C3C=C2.C(=C/C(=O)O)\C(=O)O

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