2-fluoropropane

• ChemBase ID: 97213
• Molecular Formular: C3H7F
• Molecular Mass: 62.0860832
• Monoisotopic Mass: 62.05317844
• SMILES: FC(C)C
• Canonical SMILES: CC(F)C
• InChI: InChI=1S/C3H7F/c1-3(2)4/h3H,1-2H3
• InChIKey: PRNZBCYBKGCOFI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-fluoropropane
• IUPAC Traditional name: 2-fluoropropane
• Synonyms: 2-Fluoropropane 97%

Database IDs

• CAS Number: 420-26-8
• MDL Number: MFCD00040106
• PubChem SID: 162083824
• PubChem CID: 9867

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.1458976
• LogD (pH = 7.4): 1.1458976
• Log P: 1.1458976
• Molar Refractivity: 15.7366 cm^3
• Polarizability: 5.974684 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -133.4°C
• Boiling Point: -10°C
• Density: 0.969
• Refractive Index: 1.3282

Safety Information

• Storage Warning: Extremely Flammable/Irritant

DETAILS

Apollo Scientific Ltd - PC4179T

Cylinder - 1/4" NPT connection