2-ethoxy-5-iodopyridine

• ChemBase ID: 297445
• Molecular Formular: C7H8INO
• Molecular Mass: 249.04899
• Monoisotopic Mass: 248.96506188
• SMILES: CCOc1ccc(cn1)I
• Canonical SMILES: CCOc1ccc(cn1)I
• InChI: InChI=1S/C7H8INO/c1-2-10-7-4-3-6(8)5-9-7/h3-5H,2H2,1H3
• InChIKey: AIFZXWONOPNLLM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-ethoxy-5-iodopyridine
• IUPAC Traditional name: 2-ethoxy-5-iodopyridine
• Synonyms: 2-Ethoxy-5-iodopyridine; 2-乙氧基-5-碘吡啶

Database IDs

• CAS Number: 902837-52-9
• MDL Number: MFCD07781181
• PubChem SID: 180682976
• PubChem CID: 42553167

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 2.4780915
• LogD (pH = 7.4): 2.4781117
• Log P: 2.478112
• Molar Refractivity: 48.7889 cm^3
• Polarizability: 19.021267 Å^3
• Polar Surface Area: 22.12 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Light Sensitive
• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26-37
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305+P351+P338-P302+P352-P321-P405-P501A

Product Information

• Purity: 95%