(S)-2-Nitro-6-octyloxy-6,7-dihydro-5H-imidazo(2,1-b)(1,3)oxazine

Base Information

• Chemical Name: (S)-2-Nitro-6-octyloxy-6,7-dihydro-5H-imidazo(2,1-b)(1,3)oxazine
• CAS No.: 187235-10-5
• Molecular Formula: C14H23N3O4
• Molecular Weight: 297.3501
• DSSTox Substance ID: DTXSID50172009
• Wikidata: Q83042145

Synonyms:187235-10-5;PA-602;(S)-2-Nitro-6-octyloxy-6,7-dihydro-5H-imidazo(2,1-b)(1,3)oxazine;Bicyclic nitroimidazole der.;(S)-2-Nitro-6-octyloxy-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine;(S)-2-Nitro-6-(octyloxy)-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine;DTXSID50172009;(6S)-2-nitro-6-octoxy-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine

Chemical Property of (S)-2-Nitro-6-octyloxy-6,7-dihydro-5H-imidazo(2,1-b)(1,3)oxazine

Chemical Property:

• Vapor Pressure: 4.64E-08mmHg at 25°C
• Boiling Point: 443.4°C at 760 mmHg
• Flash Point: 222°C
• PSA: 0.00000
• Density: 1.27g/cm³
• LogP: 0.00000
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 297.16885622
• Heavy Atom Count: 21
• Complexity: 324

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCOC1CN2C=C(N=C2OC1)[N+](=O)[O-]
• Isomeric SMILES: CCCCCCCCO[C@H]1CN2C=C(N=C2OC1)[N+](=O)[O-]

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