Cas no 79313-22-7 (1-ethyldibenzo[b,d]thiophene)
![1-ethyldibenzo[b,d]thiophene structure](https://ossimg.kuujia.com/scimg/79500/79313-22-7x500.png)
1-ethyldibenzo[b,d]thiophene structure
Product Name:1-ethyldibenzo[b,d]thiophene
CAS No:79313-22-7
MF:C14H12S
MW:212.310082435608
CID:1799908
PubChem ID:3034805
Update Time:2025-04-21
1-ethyldibenzo[b,d]thiophene Chemical and Physical Properties
Names and Identifiers
-
- 1-ethyldibenzo[b,d]thiophene
- Ethyldibenzothiophene
- DTXSID301000387
- IEFPJOMUXITDSC-UHFFFAOYSA-N
- Dibenzothiophene, 1-ethyl
- 79313-22-7
- SCHEMBL508145
- Dibenzothiophene, ethyl-
-
- Inchi： 1S/C14H12S/c1-2-10-6-5-9-13-14(10)11-7-3-4-8-12(11)15-13/h3-9H,2H2,1H3
- InChI Key： IEFPJOMUXITDSC-UHFFFAOYSA-N
- SMILES： S1C2C=CC=CC=2C2=C1C=CC=C2CC
Computed Properties
- Exact Mass: 212.06597156g/mol
- Monoisotopic Mass: 212.06597156g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 225
- 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: 5.1
- Topological Polar Surface Area: 28.2?2
1-ethyldibenzo[b,d]thiophene Related Literature
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
-
Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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