2-fluoro-5-iodopyridine

• ChemBase ID: 24230
• Molecular Formular: C5H3FIN
• Molecular Mass: 222.9868932
• Monoisotopic Mass: 222.92942532
• SMILES: c1(cnc(cc1)F)I
• Canonical SMILES: Fc1ccc(cn1)I
• InChI: InChI=1S/C5H3FIN/c6-5-2-1-4(7)3-8-5/h1-3H
• InChIKey: GYZNHUNWABYAPO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-fluoro-5-iodopyridine
• IUPAC Traditional name: 2-fluoro-5-iodopyridine
• Synonyms: 2-Fluoro-5-iodopyridine 98%; 2-Fluoro-5-iodopyridine; 2-Fluoro-5-iodopyridine; 2-氟-5-碘吡啶

Database IDs

• CAS Number: 171197-80-1
• EC Number: 000-000-0
• MDL Number: MFCD03095301
• Beilstein Number: 7756788
• PubChem SID: 160987537; 24884454
• PubChem CID: 2783179

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 2.2211504
• LogD (pH = 7.4): 2.2211504
• Log P: 2.2211504
• Molar Refractivity: 38.4947 cm^3
• Polarizability: 14.573528 Å^3
• Polar Surface Area: 12.89 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 31-33°C; 31-33°C; 33-37 °C
• Flash Point: 203 °F; 95 °C; 96°C

Safety Information

• Storage Warning: Harmful; IRRITANT; Light Sensitive
• European Hazard Symbols: Irritant (Xi); Harmful (Xn)
• German water hazard class: 3
• Risk Statements: 22-36/37/38-43; 36/37/38
• Safety Statements: 26-36/37; 26-37
• TSCA Listed: false; 否
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H302-H315-H317-H319-H335; H315-H319-H335
• GHS Precautionary statements: P261-P280-P305 + P351 + P338; P261-P305+P351+P338-P302+P352-P321-P405-P501A
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Faceshields, Gloves

Product Information

• Purity: 97%; 98%
• Empirical Formula (Hill Notation): C5H3FIN

DETAILS

Sigma Aldrich - 660043

Packaging
1, 10 g in glass bottle