Cas no 130964-29-3 (5-Isoquinolinesulfonamide,N-[2-[[3-(4-chlorophenyl)-2-propenyl]methylamino]ethyl]-)
![5-Isoquinolinesulfonamide,N-[2-[[3-(4-chlorophenyl)-2-propenyl]methylamino]ethyl]- structure](https://ossimg.kuujia.com/scimg/131000/130964-29-3x500.png)
130964-29-3 structure
Product Name:5-Isoquinolinesulfonamide,N-[2-[[3-(4-chlorophenyl)-2-propenyl]methylamino]ethyl]-
CAS No:130964-29-3
MF:C21H22ClN3O2S
MW:415.936282634735
CID:1227045
Update Time:2024-08-05
5-Isoquinolinesulfonamide,N-[2-[[3-(4-chlorophenyl)-2-propenyl]methylamino]ethyl]- Chemical and Physical Properties
Names and Identifiers
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- 5-Isoquinolinesulfonamide,N-[2-[[3-(4-chlorophenyl)-2-propenyl]methylamino]ethyl]-
- 5-Isoquinolinesulfonamide, N-[2-[[3-(4-chlorophenyl)-2-propen-1-yl]methylamino]ethyl]-
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- Inchi： 1S/C21H22ClN3O2S/c1-25(14-3-4-17-7-9-19(22)10-8-17)15-13-24-28(26,27)21-6-2-5-18-16-23-12-11-20(18)21/h2-12,16,24H,13-15H2,1H3
- InChI Key： BDBQYUKGCJHGKE-UHFFFAOYSA-N
- SMILES： C1C2=C(C(S(NCCN(CC=CC3=CC=C(Cl)C=C3)C)(=O)=O)=CC=C2)C=CN=1
Computed Properties
- Exact Mass: 415.11236
Experimental Properties
- Density: 1.293±0.06 g/cm3(Predicted)
- Boiling Point: 615.1±65.0 °C(Predicted)
- PSA: 62.3
- pka: 10.99±0.50(Predicted)
5-Isoquinolinesulfonamide,N-[2-[[3-(4-chlorophenyl)-2-propenyl]methylamino]ethyl]- Related Literature
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1. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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