1-Phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-4-methylaminobutene maleate

Base Information

• Chemical Name: 1-Phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-4-methylaminobutene maleate
• CAS No.: 52501-60-7
• Molecular Formula: C26H31NO4
• Molecular Weight: 421.5286
• Mol file: 52501-60-7.mol

Synonyms:1-Phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-4-methylaminobutene maleate;3-Buten-1-amine, N-methyl-4-phenyl-4-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-, (Z)-2-butenedioate (1:1);52501-60-7;C22H27N.C4H4O4;C22-H27-N.C4-H4-O4;LS-46921

Chemical Property of 1-Phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-4-methylaminobutene maleate

Chemical Property:

• Vapor Pressure: 2.23E-09mmHg at 25°C
• Boiling Point: 480.1°C at 760 mmHg
• Flash Point: 232.2°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 421.22530847
• Heavy Atom Count: 31
• Complexity: 496

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[NH2+]CCC=C(C1=CC=CC=C1)C2=CC3=C(CCCCC3)C=C2.C(=CC(=O)[O-])C(=O)O
• Isomeric SMILES: C[NH2+]CC/C=C(\C1=CC=CC=C1)/C2=CC3=C(CCCCC3)C=C2.C(=C\C(=O)[O-])\C(=O)O