4-nonadecylpyridine

• ChemBase ID: 132117
• Molecular Formular: C24H43N
• Molecular Mass: 345.60492
• Monoisotopic Mass: 345.33955038
• SMILES: CCCCCCCCCCCCCCCCCCCc1ccncc1
• Canonical SMILES: CCCCCCCCCCCCCCCCCCCc1ccncc1
• InChI: InChI=1S/C24H43N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-20-22-25-23-21-24/h20-23H,2-19H2,1H3
• InChIKey: UMOIOBOWJASTRT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-nonadecylpyridine
• IUPAC Traditional name: 4-nonadecylpyridine
• Synonyms: 4-Nonadecylpyridine; Proton ionophore II; ETH 1907; Hydrogen ionophore II; 4-十九基吡啶; 质子离子载体 II; 氢离子载体 II

Database IDs

• CAS Number: 70268-36-9
• MDL Number: MFCD00144460
• Beilstein Number: 217205
• PubChem SID: 162226394; 24890120
• PubChem CID: 4520357

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 8.9133625
• LogD (pH = 7.4): 9.263117
• Log P: 9.271231
• Molar Refractivity: 111.7603 cm^3
• Polarizability: 44.45138 Å^3
• Polar Surface Area: 12.89 Å^2
• Rotatable Bonds: 18
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Grade: Selectophore™
• Empirical Formula (Hill Notation): C24H43N

DETAILS

Sigma Aldrich - 95295

General description
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Other Notes
H+-ionophore showing a linear response from pH 2 to 9 in an optimized membrane composition1
Legal Information
Selectophore is a trademark of Sigma-Aldrich GmbH