2-bromotetradecane

• ChemBase ID: 302217
• Molecular Formular: C14H29Br
• Molecular Mass: 277.28406
• Monoisotopic Mass: 276.14526293
• SMILES: CCCCCCCCCCCCC(C)Br
• Canonical SMILES: CCCCCCCCCCCCC(Br)C
• InChI: InChI=1S/C14H29Br/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h14H,3-13H2,1-2H3
• InChIKey: WZGQIDWFBFDMLE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-bromotetradecane
• IUPAC Traditional name: 2-bromotetradecane
• Synonyms: 2-Bromotetradecane; 2-溴十四烷

Database IDs

• CAS Number: 74036-95-6
• EC Number: 000-000-0
• MDL Number: MFCD00045033
• Beilstein Number: 2071530

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 6.763102
• LogD (pH = 7.4): 6.763102
• Log P: 6.763102
• Molar Refractivity: 73.9972 cm^3
• Polarizability: 29.078514 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 11
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Boiling Point: 160-161°C/8mm
• Refractive Index: 1.4600

Safety Information

• TSCA Listed: 否

Product Information

• Purity: 95%