1-Propanamine, N,N-dimethyl-3-(phenyl(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)methoxy)-, (Z)-2-butenedioate, hydrate (2:2:1)

Base Information

• Chemical Name: 1-Propanamine, N,N-dimethyl-3-(phenyl(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)methoxy)-, (Z)-2-butenedioate, hydrate (2:2:1)
• CAS No.: 51490-51-8
• Molecular Formula: C27H35NO5
• Molecular Weight: 453.5705
• Mol file: 51490-51-8.mol

Synonyms:1-Propanamine, N,N-dimethyl-3-(phenyl(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)methoxy)-, (Z)-2-butenedioate, hydrate (2:2:1);51490-51-8;C23H31NO.C4H4O4.1/2H2O;LS-119500;C23-H31-N-O.C4-H4-O4.1/2H2-O

Chemical Property of 1-Propanamine, N,N-dimethyl-3-(phenyl(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)methoxy)-, (Z)-2-butenedioate, hydrate (2:2:1)

Chemical Property:

• Vapor Pressure: 2.3E-08mmHg at 25°C
• Boiling Point: 452.1°Cat760mmHg
• Flash Point: 132°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 453.25152322
• Heavy Atom Count: 33
• Complexity: 482

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCCOC(C1=CC=CC=C1)C2=CC3=C(CCCCC3)C=C2.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CN(C)CCCOC(C1=CC=CC=C1)C2=CC3=C(CCCCC3)C=C2.C(=C/C(=O)O)\C(=O)O