nitrooyl bromide

• ChemBase ID: 128629
• Molecular Formular: BrNO
• Molecular Mass: 109.9101
• Monoisotopic Mass: 108.91632563
• SMILES: BrN=O
• Canonical SMILES: BrN=O
• InChI: InChI=1S/BrNO/c1-2-3
• InChIKey: BMNDJWSIKZECMH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: nitrooyl bromide
• IUPAC Traditional name: nitrooyl bromide
• Synonyms: Nitrosyl bromide

Database IDs

• CAS Number: 13444-87-6
• PubChem SID: 162222936
• PubChem CID: 123304
• Chemspider ID: 109908
• Wikipedia Title: Nitrosyl_bromide

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 1.0815867
• LogD (pH = 7.4): 1.0815867
• Log P: 1.0815867
• Molar Refractivity: 14.8923 cm^3
• Polarizability: 5.2707033 Å^3
• Polar Surface Area: 29.43 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Red gas
• Boiling Point: 14.5°C
• Refractive Index: 1.524