Cas no 1173657-08-3 (5-Hexynenitrile, 6-[4-chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-)
![5-Hexynenitrile, 6-[4-chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]- structure](https://ossimg.kuujia.com/scimg/1174000/1173657-08-3x500.png)
1173657-08-3 structure
Product Name:5-Hexynenitrile, 6-[4-chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-
CAS No:1173657-08-3
MF:C19H14ClN3O2S
MW:383.851361751556
CID:833597
Update Time:2026-04-29
5-Hexynenitrile, 6-[4-chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]- Chemical and Physical Properties
Names and Identifiers
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- 5-Hexynenitrile, 6-[4-chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-
- 6-[4-Chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-5-h exynenitrile
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- Inchi： InChI=1S/C19H14ClN3O2S/c20-18-11-13-22-19-17(18)14-15(8-4-1-2-7-12-21)23(19)26(24,25)16-9-5-3-6-10-16/h3,5-6,9-11,13-14H,1-2,7H2
- InChI Key： KZYRNDUOTYFWMB-UHFFFAOYSA-N
- SMILES： C(CCC#N)C#CC1=CC2=C(N=CC=C2Cl)N1S(=O)(=O)C3=CC=CC=C3
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 26
- Rotatable Bond Count: 4
5-Hexynenitrile, 6-[4-chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]- Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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