Cas no 51206-82-7 (3-(4-bromophenyl)-1H-indole)
3-(4-bromophenyl)-1H-indole structure
Product Name:3-(4-bromophenyl)-1H-indole
CAS No:51206-82-7
MF:C14H10BrN
MW:272.139902591705
CID:1574270
PubChem ID:71583339
Update Time:2025-04-21
3-(4-bromophenyl)-1H-indole Chemical and Physical Properties
Names and Identifiers
-
- 3-(4-bromophenyl)-1H-indole
- LogP
- 51206-82-7
- DB-098894
-
- Inchi: 1S/C14H10BrN/c15-11-7-5-10(6-8-11)13-9-16-14-4-2-1-3-12(13)14/h1-9,16H
- InChI Key: YYGRNOXLXVUZJF-UHFFFAOYSA-N
- SMILES: BrC1C=CC(=CC=1)C1=CNC2C=CC=CC1=2
Computed Properties
- Exact Mass: 270.9997
- Monoisotopic Mass: 270.99966g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 235
- 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: 4.6
- Topological Polar Surface Area: 15.8?2
Experimental Properties
- PSA: 15.79
3-(4-bromophenyl)-1H-indole Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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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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