1,17-diazido-3,6,9,12,15-pentaoxaheptadecane

• ChemBase ID: 176320
• Molecular Formular: C12H24N6O5
• Molecular Mass: 332.35616
• Monoisotopic Mass: 332.1808179
• SMILES: C(COCCOCCOCCOCCOCCN=[N+]=[N-])N=[N+]=[N-]
• Canonical SMILES: [N-]=[N+]=NCCOCCOCCOCCOCCOCCN=[N+]=[N-]
• InChI: InChI=1S/C12H24N6O5/c13-17-15-1-3-19-5-7-21-9-11-23-12-10-22-8-6-20-4-2-16-18-14/h1-12H2
• InChIKey: OQHIMLOZSDFRID-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,17-diazido-3,6,9,12,15-pentaoxaheptadecane
• IUPAC Traditional name: 1,17-diazido-3,6,9,12,15-pentaoxaheptadecane
• Synonyms: 1,17-diazido-3,6,9,12,15-Pentaoxaheptadecane; 3,6,9,12,15-Pentaoxaheptadecane-1,17-diyl Bis-azide

Database IDs

• CAS Number: 356046-26-9
• PubChem SID: 164232230
• PubChem CID: 18759534

CALCULATED PROPERTIES

• Molar Refractivity: 82.3561 cm^3
• Polarizability: 31.047392 Å^3
• Polar Surface Area: 105.01 Å^2
• Rotatable Bonds: 18
• Lipinski's Rule of Five: true
• H Acceptors: 9
• H Donor: 0
• LogD (pH = 5.5): -0.030959057
• LogD (pH = 7.4): -0.030959057
• Log P: 0.19713224

PROPERTIES

Physical Property

• Solubility: Acetone; Dichloromethane; Ethyl Acetate; Methanol
• Apperance: Clear Colourless Oil

Safety Information

• Storage Condition: Refrigerator
• Storage Warning: Moisture Sensitive

DETAILS

Toronto Research Chemicals - P273725

A cross-linking reagent.