nonadecafluorodecanamide

• ChemBase ID: 12069
• Molecular Formular: C10H2F19NO
• Molecular Mass: 513.0986408
• Monoisotopic Mass: 512.98329987
• SMILES: C(=O)(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)N
• Canonical SMILES: NC(=O)C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• InChI: InChI=1S/C10H2F19NO/c11-2(12,1(30)31)3(13,14)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)29/h(H2,30,31)
• InChIKey: ZNCMYBRWOIPANY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: nonadecafluorodecanamide
• IUPAC Traditional name: nonadecafluorodecanamide
• Synonyms: Perfluorodecaneamide; Perfluorodecanamide 97%

Database IDs

• CAS Number: 307-40-4
• MDL Number: MFCD04038334
• PubChem SID: 160975376
• PubChem CID: 2782402

CALCULATED PROPERTIES

• Acid pKa: 1.844969
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 5.9841924
• LogD (pH = 7.4): 5.984237
• Log P: 5.707182
• Molar Refractivity: 52.8201 cm^3
• Polarizability: 20.994993 Å^3
• Polar Surface Area: 43.09 Å^2
• Rotatable Bonds: 9
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 161-163°C
• Flash Point: none°C

Safety Information

• Storage Warning: IRRITANT; Irritant
• TSCA Listed: false

Product Information

• Purity: 97%