Ethyl 4-chloro-7H-pyrrolo[2,3-D]pyrimidine-5-carboxylate

Base Information

Chemical Name:Ethyl 4-chloro-7H-pyrrolo[2,3-D]pyrimidine-5-carboxylate
CAS No.:144927-57-1
Molecular Formula:C9H8ClN3O2
Molecular Weight:225.634
Hs Code.:2933990090
DSSTox Substance ID:DTXSID50441767
Wikidata:Q72473799
Mol file:144927-57-1.mol

Synonyms:ETHYL 4-CHLORO-7H-PYRROLO[2,3-D]PYRIMIDINE-5-CARBOXYLATE;144927-57-1;MFCD11518913;Ethyl4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate;Ethyl 4-chloro-7H-pyrrolo-[2,3-d]pyrimidine-5-carboxylate;SCHEMBL355606;DTXSID50441767;AKOS015850502;AKOS028109246;CS-W006018;PB14937;DS-10852;SY012779;AM20080339;FT-0645818;A808295;J-521325;N-[1-(1-Hydroxy-2-phenyl-ethyl)-piperidin-4-yl];4-Chloro-5-ethoxycarbonyl-7H-pyrrolo[2,3-d]pyrimidine;Ethyl 4-chloro-1h-pyrrolo[2,3-d]pyrimidine-5-carboxylate;4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester;7H-PYRROLO[2,3-D]PYRIMIDINE-5-CARBOXYLIC ACID, 4-CHLORO-, ETHYL ESTER

Suppliers and Price of Ethyl 4-chloro-7H-pyrrolo[2,3-D]pyrimidine-5-carboxylate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
Ethyl4-chloro-7h-pyrrolo[2,3-d]pyrimidine-5-carboxylate
100mg
$ 90.00

SynQuest Laboratories
Ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate 97.0%
1 g
$ 790.00

SynQuest Laboratories
Ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate 97.0%
250 mg
$ 290.00

Matrix Scientific
Ethyl 4-chloro-7H-pyrrolo-[2,3-d]pyrimidine-5-carboxylate 95+%
250mg
$ 574.00

Matrix Scientific
Ethyl 4-chloro-7H-pyrrolo-[2,3-d]pyrimidine-5-carboxylate 95+%
1g
$ 1237.00

Matrix Scientific
Ethyl 4-chloro-7H-pyrrolo-[2,3-d]pyrimidine-5-carboxylate 95+%
5g
$ 3749.00

J&W Pharmlab
Ethyl4-chloro-7h-pyrrolo[2,3-d]pyrimidine-5-carboxylate 96%
5g
$ 1998.00

J&W Pharmlab
Ethyl4-chloro-7h-pyrrolo[2,3-d]pyrimidine-5-carboxylate 96%
1g
$ 598.00

Crysdot
Ethyl4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate 97%
5g
$ 598.00

Chemenu
ethyl4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate 95%+
5g
$ 1017.00

Total 40 raw suppliers

Chemical Property of Ethyl 4-chloro-7H-pyrrolo[2,3-D]pyrimidine-5-carboxylate

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Melting Point:140-141 °C
Refractive Index:1.644
Boiling Point:397.056 °C at 760 mmHg
PKA:9.72±0.20(Predicted)
Flash Point:193.933 °C
PSA：67.87000
Density:1.459 g/cm³
LogP:1.78800
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:225.0305042
Heavy Atom Count:15
Complexity:252

Purity/Quality:

99%, ^*data from raw suppliers

Ethyl4-chloro-7h-pyrrolo[2,3-d]pyrimidine-5-carboxylate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C1=CNC2=C1C(=NC=N2)Cl

Technology Process of Ethyl 4-chloro-7H-pyrrolo[2,3-D]pyrimidine-5-carboxylate

There total 2 articles about Ethyl 4-chloro-7H-pyrrolo[2,3-D]pyrimidine-5-carboxylate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 74.0%

: 22276-95-5
5-bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidine

: 541-41-3
chloroformic acid ethyl ester

: 144927-57-1
4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester

Guidance literature:: 5-bromo-4-chloro-7H-pyrrolo[2,3-d]pyrimidine; With n-butyllithium; In tetrahydrofuran; hexane; at -65 ℃; for 0.5h; Inert atmosphere;

chloroformic acid ethyl ester; In tetrahydrofuran; hexane; at 20 ℃;

With ammonium chloride; In tetrahydrofuran; hexane; water;

Reference yield:

: 3680-69-1
4-chloro-1H-pyrrolo[2,3-d]pyrimidine

: 144927-57-1
4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid ethyl ester

Guidance literature:: Multi-step reaction with 2 steps

1.1: N-Bromosuccinimide / chloroform / 1 h / Reflux

2.1: n-butyllithium / hexane; tetrahydrofuran / 0.5 h / -65 °C / Inert atmosphere

2.2: 20 °C

With N-Bromosuccinimide; n-butyllithium; In tetrahydrofuran; hexane; chloroform;