Cas no 127703-37-1 (2-(3-Cyanophenyl)-4-methylphenol)
127703-37-1 structure
Product Name:2-(3-Cyanophenyl)-4-methylphenol
CAS No:127703-37-1
MF:C14H11NO
MW:209.243243455887
CID:2139588
Update Time:2023-08-04
2-(3-Cyanophenyl)-4-methylphenol Chemical and Physical Properties
Names and Identifiers
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- 2-(3-Cyanophenyl)-4-methylphenol
- JBNKNQBVTWRFQK-UHFFFAOYSA-N
- 2'-Hydroxy-5'-methyl-[1,1'-biphenyl]-3-carbonitrile
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- Inchi： 1S/C14H11NO/c1-10-5-6-14(16)13(7-10)12-4-2-3-11(8-12)9-15/h2-8,16H,1H3
- InChI Key： JBNKNQBVTWRFQK-UHFFFAOYSA-N
- SMILES： OC1=CC=C(C)C=C1C1C=CC=C(C#N)C=1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 280
- Topological Polar Surface Area: 44
2-(3-Cyanophenyl)-4-methylphenol Related Literature
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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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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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