cis-2,3,4,4a,5,6,11,11a-Octahydro-2-ethyl-1H-pyrido(4,3-b)carbazole (E)-2-butenedioate (1:1)

Base Information

• Chemical Name: cis-2,3,4,4a,5,6,11,11a-Octahydro-2-ethyl-1H-pyrido(4,3-b)carbazole (E)-2-butenedioate (1:1)
• CAS No.: 112853-68-6
• Molecular Formula: C21H26N2O4
• Molecular Weight: 370.4421
• Mol file: 112853-68-6.mol

Synonyms:cis-2,3,4,4a,5,6,11,11a-Octahydro-2-ethyl-1H-pyrido(4,3-b)carbazole (E)-2-butenedioate (1:1);112853-68-6;4a-11a-cis-2-Ethyl-1,2,3,4,4a,5,11,11a-octahydro-6H-pyrido(4,3-b)carbazole fumarate;1H-Pyrido(4,3-b)carbazole, 2,3,4,4a,5,6,11,11a-octahydro-2-ethyl-, cis-, (E)-2-butenedioate (1:1);C17-H22-N2.C4-H4-O4;LS-133303

Chemical Property of cis-2,3,4,4a,5,6,11,11a-Octahydro-2-ethyl-1H-pyrido(4,3-b)carbazole (E)-2-butenedioate (1:1)

Chemical Property:

• Vapor Pressure: 7.38E-07mmHg at 25°C
• Boiling Point: 407.7°Cat760mmHg
• Flash Point: 200.4°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 370.18925731
• Heavy Atom Count: 27
• Complexity: 448

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCN1CCC2CC3=C(CC2C1)C4=CC=CC=C4N3.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CCN1CC[C@@H]2CC3=C(C[C@@H]2C1)C4=CC=CC=C4N3.C(=C/C(=O)O)\C(=O)O