4-Chloro-5-iodo-7H-pyrrol[2,3-d]pyrimidine

Synonym(s):4-Chloro-5-iodo-7H-pyrrolo[2,3-d]pyrimidine

CAS NO.：123148-78-7
Empirical Formula: C6H3ClIN3
Molecular Weight: 279.47
MDL number: MFCD09263258
EINECS: 626-377-7
SAFETY DATA SHEET (SDS)
Update Date: 2024-10-23 13:36:13

4-Chloro-5-iodo-7H-pyrrol[2,3-d]pyrimidine Structural

What is 4-Chloro-5-iodo-7H-pyrrol[2,3-d]pyrimidine?

The Uses of 4-Chloro-5-iodo-7H-pyrrol[2,3-d]pyrimidine

6-Chloro-7-iodo-7-deazapurine is used as pharmaceutical intermediate.

Definition

4-Chloro-5-iodo-7H-pyrrol[2,3-d]pyrimidine, also known as 6-Chloro-7-iodo-7-deazapurine or 4-Chloro-5-iodo-1H-pyrrolo[2,3-d]pyrimidine, is a white solid that can be obtained by iodine reaction of 4-chloro-7h-pyrrole [2,3-d] pyrimidine with NIS.

Synthesis

4-chloro-7h-pyrrole [2,3-d] pyrimidine (8.0 g, 52.32 mmol, 1.0 eq) was dissolved in DMF(40 mL) and NIS(15.7g, 57.55 mmol, 1.1eq) was added at 0℃. After stirring at room temperature overnight, 200 mL of saturated Na2S2O3 solution was added. The mixture was filtered, washed with water three times, and vacuum drying, to obtain 4-Chloro-5-iodo-7H-pyrrol[2,3-d]pyrimidine.

Properties of 4-Chloro-5-iodo-7H-pyrrol[2,3-d]pyrimidine

Melting point:	179-183 °C
Boiling point:	241.0±50.0 °C(Predicted)
Density	2.47±0.1 g/cm3(Predicted)
storage temp.	Keep in dark place,Sealed in dry,Room Temperature
form	powder to crystal
pka	9.61±0.20(Predicted)
color	White to Orange to Green
Water Solubility	Insoluble in water.
Sensitive	Light Sensitive
λmax	305nm(H2O)(lit.)

Safety information for 4-Chloro-5-iodo-7H-pyrrol[2,3-d]pyrimidine

Signal word	Warning
Pictogram(s)	Exclamation Mark Irritant GHS07
GHS Hazard Statements	H302:Acute toxicity,oral H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes	P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.