Cas no 1168106-92-0 (5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile)
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile is a heterocyclic compound featuring a pyrrolopyrimidine core substituted with a bromine atom at the 5-position and a cyano group at the 4-position. This structure makes it a versatile intermediate in medicinal chemistry and pharmaceutical research, particularly for the synthesis of kinase inhibitors and other biologically active molecules. The bromo substituent enhances reactivity for further functionalization via cross-coupling reactions, while the electron-withdrawing cyano group contributes to its utility in nucleophilic substitution and cyclization reactions. Its high purity and stability under standard conditions ensure reliable performance in synthetic applications. This compound is particularly valuable for developing targeted therapeutics due to its modular reactivity and compatibility with diverse reaction conditions.
![5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile structure](https://ossimg.kuujia.com/scimg/1168500/1168106-92-0x500.png)
1168106-92-0 structure
Product Name:5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile
CAS No:1168106-92-0
MF:C7H3BrN4
MW:223.029519319534
CID:1028786
PubChem ID:68877240
Update Time:2025-06-07
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile
- DA-37702
- SCHEMBL4012627
- CS-0006621
- 1168106-92-0
- DTXSID80739189
-
- Inchi： 1S/C7H3BrN4/c8-4-2-10-7-6(4)5(1-9)11-3-12-7/h2-3H,(H,10,11,12)
- InChI Key： MFKMGFPWWHXGGL-UHFFFAOYSA-N
- SMILES： BrC1=CNC2C1=C(C#N)N=CN=2
Computed Properties
- Exact Mass: 221.95411g/mol
- Monoisotopic Mass: 221.95411g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 223
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 65.4?2
Experimental Properties
- Density: 1.99
- Boiling Point: 241 oC
- Flash Point: 100 oC
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM152130-100mg |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile |
1168106-92-0 | 95%+ | 100mg |
$1017 | 2021-08-05 | |
| Chemenu | CM152130-250mg |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile |
1168106-92-0 | 95%+ | 250mg |
$1220 | 2021-08-05 | |
| Chemenu | CM152130-1g |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile |
1168106-92-0 | 95%+ | 1g |
$2202 | 2021-08-05 | |
| Chemenu | CM152130-100mg |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile |
1168106-92-0 | 95%+ | 100mg |
$*** | 2023-04-03 | |
| Chemenu | CM152130-250mg |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile |
1168106-92-0 | 95%+ | 250mg |
$*** | 2023-04-03 | |
| Chemenu | CM152130-500mg |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile |
1168106-92-0 | 95%+ | 500mg |
$672 | 2022-06-14 | |
| Chemenu | CM152130-1g |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile |
1168106-92-0 | 95%+ | 1g |
$*** | 2023-04-03 | |
| Biosynth | TWB10692-50 mg |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile |
1168106-92-0 | 50mg |
$110.00 | 2023-01-02 | ||
| Biosynth | TWB10692-100 mg |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile |
1168106-92-0 | 100MG |
$176.00 | 2023-01-02 | ||
| Biosynth | TWB10692-250 mg |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile |
1168106-92-0 | 250MG |
$330.00 | 2023-01-02 |
5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
1168106-92-0 (5-Bromo-7H-pyrrolo[2,3-d]pyrimidine-4-carbonitrile) Related Products
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