5-O-[8-(cis-2,6-dimethylmorpholino)octylcarbamoyl]eseroline

Base Information

• Chemical Name: 5-O-[8-(cis-2,6-dimethylmorpholino)octylcarbamoyl]eseroline
• CAS No.: 154619-51-9
• Molecular Formula: C28H46 N4 O3
• Molecular Weight: 486.6898
• DSSTox Substance ID: DTXSID40935024
• Nikkaji Number: J960.972E
• Wikidata: Q27120532
• Metabolomics Workbench ID: 56530
• Mol file: 154619-51-9.mol

Synonyms:(3aS,8aR)-1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethylpyrrolo(2,3-b)indol-5-ol(8-(cis2,6-dimethylmorpholin-4-yl)octyl)carbamate L-bitartrate hydrate;MF 268;MF-268

Chemical Property of 5-O-[8-(cis-2,6-dimethylmorpholino)octylcarbamoyl]eseroline

Chemical Property:

• Vapor Pressure: 6.49E-14mmHg at 25°C
• Boiling Point: 590.4°Cat760mmHg
• Flash Point: 310.9°C
• Density: 1.066g/cm³
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 11
• Exact Mass: 486.35699134
• Heavy Atom Count: 35
• Complexity: 683

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CN(CC(O1)C)CCCCCCCCNC(=O)OC2=CC3=C(C=C2)N(C4C3(CCN4C)C)C
• Isomeric SMILES: C[C@@H]1CN(C[C@@H](O1)C)CCCCCCCCNC(=O)OC2=CC3=C(C=C2)N([C@@H]4[C@]3(CCN4C)C)C

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