ChemicalBook >> CAS DataBase List >>4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine

4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine

CAS No.
479633-63-1
Chemical Name:
4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine
Synonyms
Tofacitinib Impurity 20;4-Chloro-7-(toluene-4-sulfonyl)-7H-pyrrolo[2,3-d]pyrimidine;Tofacitinib-9;Tofacitinib imurity;Tofatinib Impurity 1;Tofatinib Impurity P;Tofacitinib Impurity R;Tofacitinib Impurity 53;Tofacitinib Impurity 163;4-Chloro-7-tosyl-7H-pyrro...
CBNumber:
CB32452480
Molecular Formula:
C13H10ClN3O2S
Molecular Weight:
307.76
MDL Number:
MFCD09907939
MOL File:
479633-63-1.mol
TDS File:
TDS
Last updated:2026-05-28 01:03:46
Product description Number Pack Size Price
4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine Aldrich ADE000077 1g $761
4-Chloro-7-(p-toluenesulfonyl)-7H-pyrrolo[2,3-d]pyrimidine >96.0%(HPLC)(N) C3036 1g $74
4-Chloro-7-(p-toluenesulfonyl)-7H-pyrrolo[2,3-d]pyrimidine >96.0%(HPLC)(N) C3036 5g $296
4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine ≥95% OR317249 1g $102
4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine ≥95% OR317249 5g $307
More product size

4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine Properties

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)  Exclamation Mark (GHS07)
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(39)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich ADE000077 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine Aldrich 479633-63-1 1g $761 2023-06-20 Buy
TCI Chemical C3036 4-Chloro-7-(p-toluenesulfonyl)-7H-pyrrolo[2,3-d]pyrimidine >96.0%(HPLC)(N) 479633-63-1 1g $74 2025-07-31 Buy
TCI Chemical C3036 4-Chloro-7-(p-toluenesulfonyl)-7H-pyrrolo[2,3-d]pyrimidine >96.0%(HPLC)(N) 479633-63-1 5g $296 2023-06-20 Buy
Apolloscientific OR317249 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine ≥95% 479633-63-1 1g $102 2026-06-04 Buy
Apolloscientific OR317249 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine ≥95% 479633-63-1 5g $307 2026-06-04 Buy
Product number Packaging Price Buy
ADE000077 1g $761 Buy
C3036 1g $74 Buy
C3036 5g $296 Buy
OR317249 1g $102 Buy
OR317249 5g $307 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.

Pharmaceutical Applications

4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine features a unique pyrrolo[2,3-d]pyrimidine structure, which enhances its potential as a building block in the synthesis of various biologically active molecules. Its sulfonyl group contributes to its reactivity, making it a valuable intermediate in the creation of targeted therapies, particularly in oncology and anti-inflammatory applications.

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

References

[1] Patent: WO2007/117494, 2007, A1. Location in patent: Page/Page column 61-62

3680-69-1
98-59-9
479633-63-1
Synthesis of 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine from 4-Chloro-7H-pyrrolo[2,3-d]pyrimidine and Tosyl chloride

4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine Preparation Products And Raw materials

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View Lastest Price from 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine pictures 2026-08-12 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine
479633-63-1
1KG 98%min 30tons/month WUHAN FORTUNA CHEMICAL CO., LTD
4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine pictures 2026-08-11 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine
479633-63-1
$5.00 1KG 99% Henan Fengda Chemical Co., Ltd
4-chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine pictures 2026-06-30 4-chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine
479633-63-1
1KG 98.0% 10000KGS Shaanxi Dideu New Materials Co. Ltd

4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine Spectrum

Tofacitinib Impurity R 4-Chloro-7-(p-tolylsulfonyl)pyrrolo[2,3-d]pyrimidine 4-CHLORO-7-[(4-METHYLPHENYL)SULFONYL]-7H-PYRROLO[2,3-D]PYRIMIDINE 4-CHLORO-7-TOSYL-7H-PYRROLO[2,3-D]PYRIMIDINE 4-Chloro-7-tosyl-7H-pyrro... 4-Chloro-7-[(4-methylbenzene)sulfonyl]-7H-pyrrolo[2,3-d]pyrimidine 4-Chloro-7-p-toluenesulphonyl-7H-pyrrolo[2,3-d]pyrimidine 7H-Pyrrolo[2,3-D]pyriMidine,4-chloro-7-[(4-Methylphenyl)sulfonyl]- 4-Chloro-7-tosyl-7H-pyrrolo[2 4-chloro-7-(4-methylphenyl)sulfonylpyrrolo[2,3-d]pyrimidine Tofacitinib-9 4-Chloro-7-[(4-methylbenzene)sulfonyl]pyrrolo[2,3-d]pyrimidine Tofacitinib imurity 3-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-2-yl) amino)piperidin-1-yl)-3-oxopropanenitrile 4-Chloro-7-(p-toluenesulfonyl)-7H-pyrrolo[2,3-d]pyrimidine Tofacitinib Impurity 53 Tofacitinib Impurity 20 4-Chloro-7-(p-toluenesulfonyl)-7H-pyrrolo[2,3-d]pyrimidine > 4-Chloro-7-[(4-methylphenyl)sulfonyl]-7H-pyrrolo[2,3-d]pyrim... Azilsartan medoxomil impurity345 Tofatinib Impurity 1 Tofatinib Impurity P Tofacitinib Impurity 163 4-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine 98% 4-chlorine-7-Tosyl-7H-Pyrrole[2,3-D]Pyrimidine 4-Chloro-7-(p-toluenesulfonyl)-7H-pyrrolo 4-Chloro-7-tosy1-7Hpyrrolo[2,3-d]pyrimidine 4-Chloro-7-(toluene-4-sulfonyl)-7H-pyrrolo[2,3-d]pyrimidine 3-Chloro-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine 479633-63-1 Heterocycle-Pyrimidine series ADVANCED INT.