ChemicalBook--->CAS DataBase List--->89282-03-1

89282-03-1

89282-03-1 Structure

89282-03-1 Structure
IdentificationBack Directory
[Name]

3-iodopyridin-4-ol
[CAS]

89282-03-1
[Synonyms]

3-iodopyridin-4-ol
4-Pyridinol, 3-iodo-
3-Iodo-4-hydroxypyridine
4-Hydroxy-3-iodopyridine
4-Hydroxy-3-iodopyridine 97%
3-iodopyridin-4-ol ISO 9001:2015 REACH
[Molecular Formula]

C5H4INO
[MDL Number]

MFCD01646059
[MOL File]

89282-03-1.mol
[Molecular Weight]

221
Chemical PropertiesBack Directory
[Melting point ]

303 °C(Solv: water (7732-18-5))
[Boiling point ]

336.1±22.0 °C(Predicted)
[density ]

2.142±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,2-8°C
[form ]

solid
[pka]

3.79±0.18(Predicted)
[Appearance]

White to light yellow Solid
[InChI]

InChI=1S/C5H4INO/c6-4-3-7-2-1-5(4)8/h1-3H,(H,7,8)
[InChIKey]

YMAIMLIFWHAIKB-UHFFFAOYSA-N
[SMILES]

C1=NC=CC(O)=C1I
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P280-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22
[HazardClass ]

IRRITANT
[HS Code ]

2933399990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Spectrum DetailBack Directory
[Spectrum Detail]

3-iodopyridin-4-ol(89282-03-1)1HNMR
Hazard InformationBack Directory
[Synthesis]

4-Hydroxypyridine

626-64-2

Sodium carbonate

497-19-8

3-iodopyridin-4-ol

89282-03-1

1. 4-Hydroxypyridine (4.76 g, 50.1 mmol) and sodium carbonate (Na2CO3, 10.8 g, 100 mmol) were dissolved in 200 mL of water. 2. Iodine (I2, 12.7 g, 50.1 mmol) was added to the above solution and the reaction mixture was stirred for 14 hours. 3. After completion of the reaction, the pH of the reaction mixture was adjusted to 5 with concentrated hydrochloric acid (HCl). 4. The solid obtained was suspended in boiling ethanol and thermally filtered. 5. After removal of solvent, the resulting solid was recrystallized from methanol (MeOH) to give 4-hydroxy-3-iodopyridine (5.1 g, 46% yield). 6. The product was characterized by 1H NMR (DMSO-d6) δ 8.26 (br s, 1H), 7.70 (s, 1H), 7.69 (d, J = 7 Hz, 1H), 6.14 (d, J = 7 Hz, 1H); MS (DCI/NH3) m/z: 222 (M + H)+, 239 (M + NH4)+.

[References]

[1] Patent: US6001849, 1999, A
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