3-azidooxolane

• ChemBase ID: 244229
• Molecular Formular: C4H7N3O
• Molecular Mass: 113.11788
• Monoisotopic Mass: 113.05891186
• SMILES: [N+](=[N-])=NC1CCOC1
• Canonical SMILES: [N-]=[N+]=NC1COCC1
• InChI: InChI=1S/C4H7N3O/c5-7-6-4-1-2-8-3-4/h4H,1-3H2
• InChIKey: AHFRAHLUYUUOBA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-azidooxolane
• IUPAC Traditional name: 3-azidooxolane
• Synonyms: 3-azidooxolane

Database IDs

• MDL Number: MFCD18365932
• PubChem SID: 164300139
• PubChem CID: 11217243

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 0.08894807
• LogD (pH = 7.4): 0.08894807
• Log P: 0.20299372
• Molar Refractivity: 28.1639 cm^3
• Polarizability: 10.4033375 Å^3
• Polar Surface Area: 38.66 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.099

Product Information

• Purity: 95%