ChemicalBook > CAS DataBase List > 2,4-DICHLORO-7H-PYRROLO2,3-DPYRIMIDINE

2,4-DICHLORO-7H-PYRROLO2,3-DPYRIMIDINE

Product Name
2,4-DICHLORO-7H-PYRROLO2,3-DPYRIMIDINE
CAS No.
90213-66-4
Chemical Name
2,4-DICHLORO-7H-PYRROLO2,3-DPYRIMIDINE
Synonyms
2,6-Dichloro-7-deazapurine;Tofacitinib-8;oro-7H-pyrroL;4,6-DICHLORO PURINE;o (2,3-d)pyrimidine;Tofatinib Impurity 7;2,6-dichloro-7-deazapurin ;Tofacitinib Intermediate II;2,4-Dichloro-7H-pyrrolo[2...;2,6-Dichloro-7-deazapurine>
CBNumber
CB7418105
Molecular Formula
C6H3Cl2N3
Formula Weight
188.01
MOL File
90213-66-4.mol
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2,4-DICHLORO-7H-PYRROLO2,3-DPYRIMIDINE Property

Melting point:
247-250°C
Boiling point:
312.0±52.0 °C(Predicted)
Density 
1.79±0.1 g/cm3(Predicted)
storage temp. 
Keep in dark place,Sealed in dry,Room Temperature
solubility 
Acetone (Slightly), DMSO (Slightly), Methanol (Slightly)
pka
9.18±0.20(Predicted)
form 
Solid
color 
Off-White to Yellow
Water Solubility 
Soluble in DMSO, ethyl acetate and methanol. Slightly soluble in water.
InChI
InChI=1S/C6H3Cl2N3/c7-4-3-1-2-9-5(3)11-6(8)10-4/h1-2H,(H,9,10,11)
InChIKey
GHXBPCSSQOKKGB-UHFFFAOYSA-N
SMILES
C1(Cl)=NC(Cl)=C2C=CNC2=N1
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Safety

Hazard Codes 
T
Risk Statements 
25-36-36/37/38-22
Safety Statements 
26-45-28-36
RIDADR 
UN2811
HazardClass 
IRRITANT
HS Code 
29335990
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P405Store locked up.

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N-Bromosuccinimide Price

TCI Chemical
Product number
D4284
Product name
2,6-Dichloro-7-deazapurine
Purity
>98.0%(HPLC)(N)
Packaging
1g
Price
$33
Updated
2025/07/31
TCI Chemical
Product number
D4284
Product name
2,6-Dichloro-7-deazapurine
Purity
>98.0%(HPLC)(N)
Packaging
5g
Price
$79
Updated
2025/07/31
Usbiological
Product number
D3530-65
Product name
2,6-Dichloro-7-deazapurine
Packaging
500mg
Price
$382
Updated
2021/12/16
TRC
Product number
D434025
Product name
2,6-Dichloro-7-deazapurine
Packaging
25g
Price
$100
Updated
2021/12/16
AK Scientific
Product number
J92474
Product name
2,4-Dichloro-7H-pyrrolo[2,3-d]pyrimidine
Packaging
25g
Price
$112
Updated
2021/12/16
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2,4-DICHLORO-7H-PYRROLO2,3-DPYRIMIDINE Chemical Properties,Usage,Production

Chemical Properties

Crystalline Solid

Uses

It is used as a pharmaceutical intermediate.

Synthesis

39929-79-8

90213-66-4

General procedure for the synthesis of 2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidines from 2,4-dihydroxypyrrolo[2,3-d]pyrimidines: 7H-pyrrolo[2,3-d]pyrimidine-2,4-diol (10.0 g, 66.2 mmol) and toluene (30 ml) were added to a reactor equipped with a stirrer. Phosphoryl chloride (18.5 ml, 198.5 mmol) was added slowly under stirring and the reaction system was subsequently warmed to 70 °C. Diisopropylethylamine (23.0 ml, 132.3 mmol) was added dropwise over 2.5 h to control the exothermic nature of the reaction. After the dropwise addition, the reaction temperature was raised to 106 °C and stirring was continued at this temperature for 16 hours. After completion of the reaction, the mixture was cooled to 25 °C and then slowly poured into a flask containing water (230 ml) and ethyl acetate (120 ml) and stirred overnight at room temperature. The reaction mixture was filtered through diatomaceous earth and then layered, the aqueous layer was extracted with ethyl acetate (3 x 75 ml). The organic layers were combined and washed with brine (100 ml). Darco KBB (1.24 g) was added to the organic layer, filtered again through diatomaceous earth and dried with anhydrous sodium sulfate (10.0 g). Finally, the solution was concentrated under reduced pressure to afford the target product 2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine in 52% yield.

References

[1] European Journal of Medicinal Chemistry, 2012, vol. 52, p. 205 - 212
[2] Patent: WO2007/12953, 2007, A2. Location in patent: Page/Page column 24
[3] Patent: US2010/3250, 2010, A1. Location in patent: Page/Page column 20
[4] Journal of Medicinal Chemistry, 2010, vol. 53, # 8, p. 3169 - 3182
[5] Patent: US2009/54425, 2009, A1. Location in patent: Page/Page column 21

2,4-DICHLORO-7H-PYRROLO2,3-DPYRIMIDINE Preparation Products And Raw materials

Raw materials

Preparation Products

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2,4-DICHLORO-7H-PYRROLO2,3-DPYRIMIDINE Suppliers

Shanghai Boc Chemical Co.,Ltd
Tel
021-34975603-808 18721111801
Fax
+86-21-34975602-805
Email
sales@bocpharma.com
Country
China
ProdList
1009
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Bayee Biotech (Anqing) Co., Ltd.
Tel
0556-5032306 18917961636
Email
wtx@bayeebio.com
Country
China
ProdList
239
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61
Gansu HaoTian Chemical Technology Co., Ltd.
Tel
0943-6900332 17789447501
Fax
0931-8238232
Email
zhuanxiajiang@haotianpharm.com
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China
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192
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BEIJING GOLDEN OLIVE COMPANY
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010-82904532 15311296095
Email
mary@goldolive.com
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China
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Anhui Leyong Biotechnology Co.,Ltd
Tel
15055708011
Email
2093564781@qq.com
Country
China
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Chongqing Xingcan Pharmaceutical Technology Co., Ltd.
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023-13650506873 19923294409
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xingcanyaoye@sina.com
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China
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ANHUI JINGKE BIOTECHNOLOGY CO.,LTD
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0551-65206518 18133676923
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taozz@kingobiotech.com
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China
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SiChuang NanBu Honesty Technology Co., Ltd.
Tel
0838-5675166 15883665058
Fax
0838-5675535
Email
nbcxkj@126.com
Country
China
ProdList
918
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J & K SCIENTIFIC LTD.
Tel
18210857532; 18210857532
Fax
86-10-82849933
Email
jkinfo@jkchemical.com
Country
China
ProdList
96815
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Meryer (Shanghai) Chemical Technology Co., Ltd.
Tel
4006356688 18621169109
Fax
86-21-61259102
Email
market03@meryer.com
Country
China
ProdList
40228
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View Lastest Price from 2,4-DICHLORO-7H-PYRROLO2,3-DPYRIMIDINE manufacturers

Hefei Lbao Physical & Chemical Science Co.,Ltd
Product
2,4-Dichloro-7H-pyrrolo[2,3-d]pyrimidine 90213-66-4
Price
US $0.00/kg
Min. Order
1kg
Purity
98%
Supply Ability
Customise
Release date
2025-11-27
Jinan Finer Chemical Co., Ltd
Product
2,4-Dichloro-1H-pyrrolo[2,3-d]pyrimidine 90213-66-4
Price
US $0.00/Kg/Drum
Min. Order
1KG
Purity
99%
Supply Ability
20mt/year
Release date
2021-06-18
Shaanxi Xianhe Biotech Co., Ltd
Product
2,4-Dichloro-7H-pyrrolo[2,3-d]pyrimidine 90213-66-4
Price
US $0.00/kg
Min. Order
1kg
Purity
0.99
Supply Ability
1000kg
Release date
2025-04-18

90213-66-4, 2,4-DICHLORO-7H-PYRROLO2,3-DPYRIMIDINERelated Search:


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