5,5,6,6,7,7,8,8,9,9,10,10,10-tridecafluorodeca-1,3-diene

• ChemBase ID: 94341
• Molecular Formular: C10H5F13
• Molecular Mass: 372.1259416
• Monoisotopic Mass: 372.01836702
• SMILES: FC(F)(F)C(F)(F)C(C(F)(C(F)(F)C(/C=C/C=C)(F)F)F)(F)F
• Canonical SMILES: C=C/C=C/C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• InChI: InChI=1S/C10H5F13/c1-2-3-4-5(11,12)6(13,14)7(15,16)8(17,18)9(19,20)10(21,22)23/h2-4H,1H2
• InChIKey: HALRAMNRSBXAOM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5,5,6,6,7,7,8,8,9,9,10,10,10-tridecafluorodeca-1,3-diene
• IUPAC Traditional name: 5,5,6,6,7,7,8,8,9,9,10,10,10-tridecafluorodeca-1,3-diene
• Synonyms: 1H,1H,2H,3H,4H-Perfluorodeca-1,3-diene 97%

Database IDs

• MDL Number: MFCD00156009
• PubChem SID: 162080995
• PubChem CID: 5708682

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 5.8883004
• LogD (pH = 7.4): 5.8883004
• Log P: 5.8883004
• Molar Refractivity: 50.2404 cm^3
• Polarizability: 18.091433 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Warning: Irritant