alpha-Obscurine

Base Information

• Chemical Name: alpha-Obscurine
• CAS No.: 596-55-4
• Molecular Formula: C17H26N2O
• Molecular Weight: 274.4011
• Wikidata: Q27108615
• Metabolomics Workbench ID: 70680
• Mol file: 596-55-4.mol

Synonyms:alpha-Obscurine;596-55-4;C09889;CHEBI:10322;AKOS040761339;MS-23906;PD166679;HY-134036;CS-0137028;E80798;Q27108615

Chemical Property of alpha-Obscurine

Chemical Property:

• Vapor Pressure: 4.78E-09mmHg at 25°C
• Melting Point: 283-284 °C(Solv: methanol (67-56-1))
• Boiling Point: 471.1°Cat760mmHg
• PKA: 16.04±0.40(Predicted)
• Flash Point: 238.7°C
• PSA: 35.83000
• Density: 1.14g/cm³
• LogP: 2.89470
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 274.204513457
• Heavy Atom Count: 20
• Complexity: 483

Purity/Quality:

99% ^*data from raw suppliers

α-Obscurine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC2CC3=C(CCC(=O)N3)C4(C1)C2CCCN4C
• Isomeric SMILES: C[C@@H]1C[C@H]2CC3=C(CCC(=O)N3)[C@@]4(C1)[C@@H]2CCCN4C

Technology Process of alpha-Obscurine

There total 1 articles about alpha-Obscurine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ α-Obscurin (596-55-4,3279-74-1,85354-38-7)

Guidance literature:

Des-N-methyl-α-obscurin, CH2O/HCOOH;