4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine
![4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine Structure](CAS/GIF/479633-63-1.gif)
- CAS No.
- 479633-63-1
- Chemical Name:
- 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine
- Synonyms
- Tofacitinib Impurity 20;Tofacitinib-9;Tofacitinib imurity;Tofatinib Impurity 1;Tofatinib Impurity P;Tofacitinib Impurity R;Tofacitinib Impurity 53;4-Chloro-7-tosyl-7H-pyrro...;4-Chloro-7-tosyl-7H-pyrrolo[2;Azilsartan medoxomil impurity345
- CBNumber:
- CB32452480
- Molecular Formula:
- C13H10ClN3O2S
- Molecular Weight:
- 307.76
- MOL File:
- 479633-63-1.mol
- Modify Date:
- 2024/11/14 14:09:35
Melting point | 145.0 to 149.0 °C |
---|---|
Boiling point | 505.3±60.0 °C(Predicted) |
Density | 1.49 |
storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
solubility | Chloroform (Slightly), DMSO (Slightly) |
form | powder to crystal |
pka | 1.73±0.30(Predicted) |
color | White to Orange to Green |
InChI | InChI=1S/C13H10ClN3O2S/c1-9-2-4-10(5-3-9)20(18,19)17-7-6-11-12(14)15-8-16-13(11)17/h2-8H,1H3 |
InChIKey | BTOJSYRZQZOMOK-UHFFFAOYSA-N |
SMILES | C1=NC(Cl)=C2C=CN(S(C3=CC=C(C)C=C3)(=O)=O)C2=N1 |
SAFETY
Risk and Safety Statements
Symbol(GHS) | ![]() GHS07 |
---|---|
Signal word | Warning |
Hazard statements | H315-H319 |
Precautionary statements | P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313 |
Hazard Codes | Xn |
Risk Statements | 22 |
HazardClass | IRRITANT |
HS Code | 2933599590 |
4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine price More Price(3)
Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
---|---|---|---|---|---|---|---|
Sigma-Aldrich(India) | ADE000077 | 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine AldrichCPR | 479633-63-1 | 1G | ₹68706.28 | 2022-06-14 | Buy |
TCI Chemicals (India) | C3036 | 4-Chloro-7-(p-toluenesulfonyl)-7H-pyrrolo[2,3-d]pyrimidine | 479633-63-1 | 1G | ₹8000 | 2022-05-26 | Buy |
TCI Chemicals (India) | C3036 | 4-Chloro-7-(p-toluenesulfonyl)-7H-pyrrolo[2,3-d]pyrimidine | 479633-63-1 | 5G | ₹18200 | 2022-05-26 | Buy |
4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine Chemical Properties,Uses,Production
Uses
4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine is a reagent in the synthesis of (+)-tofacitinib, a selective Janus kinase 3 inhibitor (JAK3) and an immunosuppressant drug.
Synthesis
4-Chloro-7H-pyrrolo[2,3-d]pyrimidine (2kg, 12.96mol) and dichloromethane (40L) were added to the reaction flask at room temperature, stirred and dissolved. Triethylamine (3.88 kg, 38.4 mol) and 4-dimethylamino pyridine (157.6 g, 1.28 mol) were added in that order, and after stirring and dissolved, p-toluenesulfonyl chloride (2.6 kg, 13.6 mol) was added dropwise at 0 °C. The chloromethane (30 L) solution was added dropwise, and the mixture was stirred at room temperature for 30 min. After the TLC was applied, the mixture was washed with water (16L×3). 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine (3.9 kg, yield 97.7%) was obtained after drying under reduced pressure.
4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine Preparation Products And Raw materials
Raw materials
Preparation Products
Supplier | Tel | Country | ProdList | Advantage | Inquiry |
---|---|---|---|---|---|
EPOCH LABS | +91-7702174901 +91-9515109812 | Hyderabad, India | 68 | 58 | Inquiry |
VGS SYNTHESIS PRIVATE LIMITED | +91-9866975588 +91-9866975588 | Hyderabad, India | 1817 | 58 | Inquiry |
Varanous Labs Pvt Ltd | +91-7036248882 +91-7036248882 | Hyderabad, India | 1537 | 58 | Inquiry |
Shreyasvi Lifesciences Pvt Ltd | +919848346660 | Telangana, India | 66 | 58 | Inquiry |
PSN Medicare Private Limited | +91-9030090313 +91-7702388996 | Telangana, India | 82 | 58 | Inquiry |
Opulent Pharma | 08068441147Ext 981 | Gujarat, India | 810 | 58 | Inquiry |
A.J Chemicals | 91-9810153283 | New Delhi, India | 6100 | 58 | Inquiry |
CLEARSYNTH LABS LTD. | +91-22-45045900 | Hyderabad, India | 6257 | 58 | Inquiry |
Pharmaffiliates Analytics and Synthetics P. Ltd | +91-172-5066494 | Haryana, India | 6739 | 58 | Inquiry |
TCI Chemicals (India) Pvt. Ltd. | 1800 425 7889 | New Delhi, India | 6768 | 58 | Inquiry |
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