Cas no 52380-85-5 (4-Phenylbenzo[b]thiophene)
![4-Phenylbenzo[b]thiophene structure](https://ossimg.kuujia.com/scimg/52500/52380-85-5x500.png)
4-Phenylbenzo[b]thiophene structure
Product Name:4-Phenylbenzo[b]thiophene
CAS No:52380-85-5
MF:C14H10S
MW:210.294202327728
CID:2669194
PubChem ID:14398699
Update Time:2025-04-21
4-Phenylbenzo[b]thiophene Chemical and Physical Properties
Names and Identifiers
-
- 4-Phenylbenzo[b]thiophene
- SCHEMBL4315241
- 52380-85-5
- NJCJOKLCLFCCON-UHFFFAOYSA-N
- DB-123554
- benzo[b]thiophene,4-phenyl-
- 4-PHENYL-1-BENZOTHIOPHENE
-
- Inchi： 1S/C14H10S/c1-2-5-11(6-3-1)12-7-4-8-14-13(12)9-10-15-14/h1-10H
- InChI Key： NJCJOKLCLFCCON-UHFFFAOYSA-N
- SMILES： S1C=CC2=C1C=CC=C2C1C=CC=CC=1
Computed Properties
- Exact Mass: 210.05032149Da
- Monoisotopic Mass: 210.05032149Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 207
- 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: 28.2?2
4-Phenylbenzo[b]thiophene Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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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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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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