Cas no 922184-53-0 (1H-Indole-3-carbonitrile, 2-methyl-1-phenyl-)
922184-53-0 structure
Product Name:1H-Indole-3-carbonitrile, 2-methyl-1-phenyl-
CAS No:922184-53-0
MF:C16H12N2
MW:232.279883384705
CID:741518
PubChem ID:71421592
Update Time:2025-04-19
1H-Indole-3-carbonitrile, 2-methyl-1-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-3-carbonitrile, 2-methyl-1-phenyl-
- 2-methyl-1-phenylindole-3-carbonitrile
- 2-Methyl-1-phenyl-1H-indole-3-carbonitrile
- 922184-53-0
- DTXSID70840652
-
- Inchi： 1S/C16H12N2/c1-12-15(11-17)14-9-5-6-10-16(14)18(12)13-7-3-2-4-8-13/h2-10H,1H3
- InChI Key： PNBWKWPILIFOOM-UHFFFAOYSA-N
- SMILES： N1(C2C=CC=CC=2)C(C)=C(C#N)C2C=CC=CC1=2
Computed Properties
- Exact Mass: 232.100048391g/mol
- Monoisotopic Mass: 232.100048391g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 336
- 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: 3.8
- Topological Polar Surface Area: 28.7?2
1H-Indole-3-carbonitrile, 2-methyl-1-phenyl- Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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