2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Base Information

Chemical Name:2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
CAS No.:124738-81-4
Molecular Formula:C₇H₄ClN₅
Molecular Weight:193.595
Hs Code.:2933990090
ChEMBL ID:CHEMBL4097157
DSSTox Substance ID:DTXSID30559293
Nikkaji Number:J1.996.394B
Wikidata:Q82441963
Mol file:124738-81-4.mol

Synonyms:2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile;124738-81-4;CHEMBL4097157;7H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile, 2-amino-4-chloro-;DTXSID30559293;BDBM50257868;AKOS022175331;CS-0128200

Suppliers and Price of 2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

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

Crysdot
2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile 95+%
100mg
$ 580.00

Chemenu
2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile 95%+
1g
$ 3017.00

AccelPharmtech
2-amino-4-chloro-7H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile 97.00%
25G
$ 8510.00

AccelPharmtech
2-amino-4-chloro-7H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile 97.00%
1G
$ 2640.00

Total 2 raw suppliers

Chemical Property of 2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

Chemical Property:

Melting Point:>300 °C
Boiling Point:286.9±50.0 °C(Predicted)
PKA:8.10±0.20(Predicted)
PSA：92.11000
Density:1.83±0.1 g/cm3(Predicted)
LogP:0.99528
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:0
Exact Mass:193.0155228
Heavy Atom Count:13
Complexity:249

Purity/Quality:

99% ^*data from raw suppliers

2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=C(C2=C(N1)N=C(N=C2Cl)N)C#N

Technology Process of 2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

There total 5 articles about 2-Amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile 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: 40.0%

: 124738-80-3
2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine-5-carboxamide

: 124738-81-4
2-amino-4-chloro-5-cyanopyrrolo<2,3-d>pyrimidine

Guidance literature:: With N,N-diethylaniline; trichlorophosphate; Heating;
DOI:10.1039/c39890000560

Reference yield: 37.0%

: 69205-79-4
2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

: 124738-81-4
2-amino-4-chloro-5-cyanopyrrolo<2,3-d>pyrimidine

Guidance literature:: With triethylamine; trichlorophosphate; In acetonitrile; at 65 - 95 ℃;
DOI:10.1002/adsc.201200109

Reference yield:

: N-(7-acetyl-5-cyano-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-2-yl)acetamide

: 124738-81-4
2-amino-4-chloro-5-cyanopyrrolo<2,3-d>pyrimidine

Guidance literature:: With N,N-dimethyl-aniline; trichlorophosphate; In acetonitrile; at 100 ℃; for 6h; Inert atmosphere;
DOI:10.1021/acs.jmedchem.7b00484