Buxamine E

Base Information

• Chemical Name: Buxamine E
• CAS No.: 14317-17-0
• Molecular Formula: C26H44 N2
• Molecular Weight: 384.641
• DSSTox Substance ID: DTXSID50332025
• Nikkaji Number: J15.421K
• Wikidata: Q27106003
• Mol file: 14317-17-0.mol

Synonyms:Buxamine E;14317-17-0;(6S,8R,11R,12S,15S,16R)-15-[(1S)-1-aminoethyl]-N,N,7,7,12,16-hexamethyltetracyclo[9.7.0.03,8.012,16]octadeca-1(18),2-dien-6-amine;C10795;CHEBI:3249;DTXSID50332025;Q27106003

Chemical Property of Buxamine E

Chemical Property:

• Vapor Pressure: 1.04E-09mmHg at 25°C
• Boiling Point: 488.9°Cat760mmHg
• Flash Point: 241°C
• PSA: 29.26000
• Density: 1.01g/cm³
• LogP: 6.48940
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 384.350449412
• Heavy Atom Count: 28
• Complexity: 687

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1CCC2(C1(CC=C3C2CCC4C(=C3)CCC(C4(C)C)N(C)C)C)C)N
• Isomeric SMILES: C[C@@H]([C@H]1CC[C@@]2([C@@]1(CC=C3[C@H]2CC[C@@H]4C(=C3)CC[C@@H](C4(C)C)N(C)C)C)C)N