10-bromodecan-1-amine hydrobromide

• ChemBase ID: 162744
• Molecular Formular: C10H23Br2N
• Molecular Mass: 317.10432
• Monoisotopic Mass: 315.01972374
• SMILES: NCCCCCCCCCCBr.Br
• Canonical SMILES: NCCCCCCCCCCBr.Br
• InChI: InChI=1S/C10H22BrN.BrH/c11-9-7-5-3-1-2-4-6-8-10-12;/h1-10,12H2;1H
• InChIKey: ZWGBEXOWJAAGPB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 10-bromodecan-1-amine hydrobromide
• IUPAC Traditional name: 10-bromodecan-1-amine hydrobromide
• Synonyms: 10-Bromo-1-decanamine Hydrobromide; 10-Bromo-1-aminodecane, Hydrobromide

Database IDs

• CAS Number: 24566-82-3
• PubChem SID: 162256879
• PubChem CID: 57376181

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 0.44527242
• LogD (pH = 7.4): 0.86504894
• Log P: 3.4692607
• Molar Refractivity: 59.3616 cm^3
• Polarizability: 23.274683 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 9
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Methanol; Water
• Apperance: Off-White to Pale Beige Solid
• Melting Point: 141-144°C

Safety Information

• Storage Condition: Refrigerator