2-methyldecane

• ChemBase ID: 294312
• Molecular Formular: C11H24
• Molecular Mass: 156.30826
• Monoisotopic Mass: 156.18780077
• SMILES: CCCCCCCCC(C)C
• Canonical SMILES: CCCCCCCCC(C)C
• InChI: InChI=1S/C11H24/c1-4-5-6-7-8-9-10-11(2)3/h11H,4-10H2,1-3H3
• InChIKey: CNPVJWYWYZMPDS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-methyldecane
• IUPAC Traditional name: 2-methyldecane
• Synonyms: 2-Methyldecane

Database IDs

• CAS Number: 6975-98-0
• MDL Number: MFCD00039994
• PubChem SID: 180679843
• PubChem CID: 23415

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 5.1964316
• LogD (pH = 7.4): 5.1964316
• Log P: 5.1964316
• Molar Refractivity: 52.3608 cm^3
• Polarizability: 21.063684 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Purity: 95+%