9-Butyramidojulolidine

Base Information

• Chemical Name: 9-Butyramidojulolidine
• CAS No.: 100796-22-3
• Molecular Formula: C13H14 N2 O4 S
• Molecular Weight: 294.3315
• Hs Code.: 2935009090
• NSC Number: 160040
• DSSTox Substance ID: DTXSID80303682
• Nikkaji Number: J65.845F
• Wikidata: Q82049086
• ChEMBL ID: CHEMBL2005121
• Mol file: 100796-22-3.mol

Synonyms:9-Butyramidojulolidine;NSC160040;N-[?]ylbutanamide;N-(2,3,6,7-Tetrahydro-1H,5H-benzo(ij)quinolizin-9-yl)butyramide;N-(2,3,6,7-Tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)butanamide;CHEMBL2005121;DTXSID80303682;Butyramide, N-(2,3,6,7-tetrahydro-1H,5H-benzo(ij)quinolizin-9-yl)-;NSC-160040;NCI60_001183

Chemical Property of 9-Butyramidojulolidine

Chemical Property:

• Melting Point: 167-169 °C(Solv: water (7732-18-5); methanol (67-56-1))
• Refractive Index: 1.581
• PKA: 5.11±0.10(Predicted)
• PSA: 100.28000
• Density: 1.324g/cm³
• LogP: 3.45220
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 258.173213330
• Heavy Atom Count: 19
• Complexity: 311

Purity/Quality:

1-Furfuryl-3-(P-tolylsulfonyl)urea ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)NC1=CC2=C3C(=C1)CCCN3CCC2