Cas no 1379355-95-9 (4-Bromoquinoline-2-carbonitrile)
1379355-95-9 structure
Product Name:4-Bromoquinoline-2-carbonitrile
CAS No:1379355-95-9
MF:C10H5BrN2
MW:233.064100980759
CID:2194510
Update Time:2023-08-07
4-Bromoquinoline-2-carbonitrile Chemical and Physical Properties
Names and Identifiers
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- 4-Bromoquinoline-2-carbonitrile
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- Inchi: 1S/C10H5BrN2/c11-9-5-7(6-12)13-10-4-2-1-3-8(9)10/h1-5H
- InChI Key: IHDYGNXQJMQIBI-UHFFFAOYSA-N
- SMILES: BrC1C=C(C#N)N=C2C=CC=CC2=1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 232
- Topological Polar Surface Area: 36.7
4-Bromoquinoline-2-carbonitrile Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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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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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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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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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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