Cas no 1190440-62-0 (2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile)
2-Oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile is a heterocyclic compound featuring a fused naphthyridine core with a carbonyl group at the 2-position and a nitrile substituent at the 3-position. This structure imparts versatility in synthetic applications, particularly as a key intermediate in pharmaceutical and agrochemical research. Its rigid bicyclic framework enhances binding affinity in medicinal chemistry, making it valuable for designing bioactive molecules. The electron-withdrawing nitrile group further facilitates functionalization via nucleophilic addition or cyclization reactions. The compound’s stability under standard conditions ensures reliable handling and storage, while its high purity (>95%) supports reproducible results in complex syntheses. Suitable for use in small-molecule drug discovery and catalyst development.
1190440-62-0 structure
Product Name:2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile
CAS No:1190440-62-0
MF:C9H9N3O
MW:175.187261343002
MDL:MFCD19689752
CID:1101150
PubChem ID:58155414
Update Time:2025-06-07
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 1,2,5,6,7,8-hexahydro-2-oxo-1,6-Naphthyridine-3-carbonitrile
- 2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile
- AKOS022709711
- 1190440-62-0
- 2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-3-carbonitrile
- DB-347275
- G58936
- SCHEMBL987318
- CS-0080604
- GSVRQIWIPOMDRZ-UHFFFAOYSA-N
- EN300-242589
-
- MDL： MFCD19689752
- Inchi： 1S/C9H9N3O/c10-4-6-3-7-5-11-2-1-8(7)12-9(6)13/h3,11H,1-2,5H2,(H,12,13)
- InChI Key： GSVRQIWIPOMDRZ-UHFFFAOYSA-N
- SMILES： O=C1C(C#N)=CC2CNCCC=2N1
Computed Properties
- Exact Mass: 175.074561919g/mol
- Monoisotopic Mass: 175.074561919g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 370
- 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: -0.9
- Topological Polar Surface Area: 64.9?2
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| 1PlusChem | 1P01E80G-50mg |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile |
1190440-62-0 | 95% | 50mg |
$239.00 | 2023-12-26 | |
| 1PlusChem | 1P01E80G-100mg |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile |
1190440-62-0 | 95% | 100mg |
$326.00 | 2023-12-26 | |
| 1PlusChem | 1P01E80G-250mg |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile |
1190440-62-0 | 95% | 250mg |
$452.00 | 2023-12-26 | |
| 1PlusChem | 1P01E80G-500mg |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile |
1190440-62-0 | 95% | 500mg |
$682.00 | 2023-12-26 | |
| 1PlusChem | 1P01E80G-1g |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile |
1190440-62-0 | 95% | 1g |
$856.00 | 2023-12-26 | |
| 1PlusChem | 1P01E80G-2.5g |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile |
1190440-62-0 | 95% | 2.5g |
$1620.00 | 2023-12-26 | |
| 1PlusChem | 1P01E80G-5g |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile |
1190440-62-0 | 95% | 5g |
$2364.00 | 2023-12-26 | |
| 1PlusChem | 1P01E80G-10g |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile |
1190440-62-0 | 95% | 10g |
$3476.00 | 2023-12-26 | |
| A2B Chem LLC | AX42384-50mg |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile |
1190440-62-0 | 95% | 50mg |
$192.00 | 2024-04-20 | |
| A2B Chem LLC | AX42384-100mg |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile |
1190440-62-0 | 95% | 100mg |
$268.00 | 2024-04-20 |
2-oxo-1,2,5,6,7,8-hexahydro-1,6-naphthyridine-3-carbonitrile Related Literature
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
-
Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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