ChemicalBook > CAS DataBase List > [4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate

[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate

Product Name
[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate
CAS No.
1146629-77-7
Chemical Name
[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate
Synonyms
Baricitinib Impurity 81;Baricitinib Impurity 42;[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl ...;4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin070yl]methyl Pivalate;Methyl[4-(1H-pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]pivalate;[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate;4- (1H pyrazole-4-yl) -7H pyrrolo [2,3-d] pyrimidin-7-yl] methyl pentanoate;[4-(1H-pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl 2,2-dimethylpropanoate;[4-(1H-pyrazole-4-yl) -7h-pyrrorole [2,3-D] pyrimidine-7-yl] methyl tevalate ester;4- (1H-pyrazol-4-yl) -7H-pyrrolo [2,3-D] pyrimidine~7-yl] methyllevulinic acid ester
CBNumber
CB62737018
Molecular Formula
C15H17N5O2
Formula Weight
299.33
MOL File
1146629-77-7.mol
More
Less

[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate Property

Boiling point:
536.7±50.0 °C(Predicted)
Density 
1.33±0.1 g/cm3(Predicted)
storage temp. 
2-8°C
pka
10.76±0.50(Predicted)
Appearance
White to off-white Solid
InChI
InChI=1S/C15H17N5O2/c1-15(2,3)14(21)22-9-20-5-4-11-12(10-6-18-19-7-10)16-8-17-13(11)20/h4-8H,9H2,1-3H3,(H,18,19)
InChIKey
CPGIWDOJHYCMRW-UHFFFAOYSA-N
SMILES
C(OCN1C2C(C=C1)=C(C1=CNN=C1)N=CN=2)(=O)C(C)(C)C
More
Less

Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

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

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

More
Less

N-Bromosuccinimide Price

TRC
Product number
P840545
Product name
[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin070yl]methylPivalate
Packaging
50mg
Price
$45
Updated
2021/12/16
AK Scientific
Product number
7776DN
Product name
(4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methylpivalate
Packaging
1g
Price
$77
Updated
2021/12/16
Ambeed
Product number
A186222
Product name
(4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methylpivalate
Purity
97%
Packaging
250mg
Price
$6
Updated
2021/12/16
Ambeed
Product number
A186222
Product name
(4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methylpivalate
Purity
97%
Packaging
1g
Price
$13
Updated
2021/12/16
Ambeed
Product number
A186222
Product name
(4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methylpivalate
Purity
97%
Packaging
5g
Price
$46
Updated
2021/12/16
More
Less

[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate Chemical Properties,Usage,Production

Chemical Properties

Type of white solid

Synthesis

269410-08-4

1146629-75-5

1146629-77-7

The general procedure for the synthesis of (4-(1H-pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methyl pivalate from 4-pyrazole boronic acid pinacol ester and (4-chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)methyl tertiarylate was performed as follows: in a reaction vessel, add (4-chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl) methyl 2,2-dimethylpropionate (10 g), water (50 mL) and potassium carbonate (15.5 g) and stirred at room temperature. Subsequently, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole (8.7 g), 1,4-dioxane (100 mL) and tetrakis(triphenylphosphine)palladium(0) (0.08 g) were added. The reaction mixture was heated to 80°C to 85°C and stirred at this temperature for 14 hours. The reaction process was monitored by thin layer chromatography. Upon completion of the reaction, ethyl acetate (100 mL) was added to the mixture and stirring was continued for 1 hour. It was then filtered through Hyflo and washed with ethyl acetate (40 mL). The organic layer was separated and concentrated under reduced pressure to afford the target product [4-(1H-pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate in 82.27% yield.

References

[1] Patent: WO2016/88094, 2016, A1. Location in patent: Page/Page column 10

[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate Preparation Products And Raw materials

Raw materials

Preparation Products

More
Less

[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate Suppliers

Anqing Xinheyuan Pharmaceutical Technology Co., Ltd
Tel
18915922978 15270619650
Email
xiang.ru@synovent.cn
Country
China
ProdList
30
Advantage
58
PharmaHands (Taizhou) Co., Ltd.
Tel
0523-86200360 18994667002
Fax
0523-86200350
Email
sales@pharmahands.com.cn
Country
China
ProdList
18
Advantage
60
shanghai Rainbow MediTech.Co.Ltd.
Tel
021-64968085,64968086-5815,5812; 13472757003
Fax
+86 21 64968087
Email
xiaoxia.zeng@rainbowpharma.cn
Country
China
ProdList
961
Advantage
65
Jinan Chenghui Shuangda biological Co., LTD
Tel
0531-0531-58897003 15550412551
Fax
0531-58897003
Email
market@jnchsd.com
Country
China
ProdList
229
Advantage
62
EnliPharma Technology Co., Ltd
Tel
0551-66399836 18955197623
Email
sales@enlipharma.com
Country
China
ProdList
1876
Advantage
55
Bide Pharmatech Ltd.
Tel
400-164-7117 13681763483
Fax
+86-21-61629029
Email
product02@bidepharm.com
Country
China
ProdList
39966
Advantage
60
Zhengzhou HongSheng Pharmaceutical Co., Ltd.
Tel
0371-0371-13526885213 15637198702
Fax
0371-63709726
Email
hsyykjchem@163.com
Country
China
ProdList
3853
Advantage
58
Shandong Zhongke Taidou Chemical Co., Ltd.
Tel
0531-88682301 18595278760
Fax
0531-62325738
Email
sdzkzf@sdzktd.com
Country
China
ProdList
112
Advantage
62
Shanghai KunRaise Chemical Technology Co., Ltd
Tel
+86-021-50935922
Fax
+86-021-33847795
Country
China
ProdList
716
Advantage
55
FarmaSino Pharmaceuticals (Anhui) Co.,Ltd.
Tel
+86-18512541987
Fax
0555-5963572
Email
hll@farmasino.com
Country
China
ProdList
241
Advantage
60
More
Less

View Lastest Price from [4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate manufacturers

ShenZhen H&D Pharmaceutical Technology Co., LTD
Product
Ruxolitinib Impurity 21 1146629-77-7
Price
US $0.00-0.00/mg
Min. Order
10mg
Purity
98%
Supply Ability
500mg
Release date
2024-08-06
Shaanxi Dideu New Materials Co. Ltd
Product
[4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate 1146629-77-7
Price
US $0.00-0.00/KG
Min. Order
1KG
Purity
98.0%
Supply Ability
10000KGS
Release date
2024-11-14
Hebei Chuanghai Biotechnology Co,.LTD
Product
[4-(1H-pyrazole-4-yl) -7h-pyrrorole [2,3-D] pyrimidine-7-yl] methyl tevalate ester 1146629-77-7
Price
US $1.00/KG
Min. Order
1KG
Purity
99.%
Supply Ability
50 ton
Release date
2024-08-23

1146629-77-7, [4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalateRelated Search:


  • [4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl pivalate
  • [4-(1H-pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl 2,2-dimethylpropanoate
  • Propanoic acid, 2,2-dimethyl-, [4-(1H-pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl ester
  • 4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin070yl]methyl Pivalate
  • [4-(1H-pyrazole-4-yl) -7h-pyrrorole [2,3-D] pyrimidine-7-yl] methyl tevalate ester
  • [4-(1H-Pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]methyl ...
  • 4- (1H pyrazole-4-yl) -7H pyrrolo [2,3-d] pyrimidin-7-yl] methyl pentanoate
  • 4- (1H-pyrazol-4-yl) -7H-pyrrolo [2,3-D] pyrimidine~7-yl] methyllevulinic acid ester
  • Baricitinib Impurity 42
  • Baricitinib Impurity 81
  • 2-(3-(4-(6-amino-5-formylpyrimidin-4-yl)-1H-pyrazol-1-yl)-1-(ethylsulfonyl)azetidin-3-yl)acetonitrile
  • Methyl[4-(1H-pyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]pivalate
  • 1146629-77-7