10-methylundec-1-ene

• ChemBase ID: 112163
• Molecular Formular: C12H24
• Molecular Mass: 168.31896
• Monoisotopic Mass: 168.18780077
• SMILES: C=CCCCCCCCC(C)C
• Canonical SMILES: C=CCCCCCCCC(C)C
• InChI: InChI=1S/C12H24/c1-4-5-6-7-8-9-10-11-12(2)3/h4,12H,1,5-11H2,2-3H3
• InChIKey: AQLBDEAOQUJAIE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 10-methylundec-1-ene
• IUPAC Traditional name: 10-methylundec-1-ene
• Synonyms: ISODODECYLENE PRACTICAL GRADE

Database IDs

• PubChem SID: 162106622
• PubChem CID: 519941

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 5.3370123
• LogD (pH = 7.4): 5.3370123
• Log P: 5.3370123
• Molar Refractivity: 57.0059 cm^3
• Polarizability: 22.682592 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Grade: PRACTICAL

DETAILS

MP Biomedicals - 05222787

MP Biomedicals Rare Chemical collection