Cas no 1033775-44-8 (5-Ethenyl-1-benzothiophene)
5-Ethenyl-1-benzothiophene structure
Product Name:5-Ethenyl-1-benzothiophene
CAS No:1033775-44-8
MF:C10H8S
MW:160.235521316528
CID:5667562
PubChem ID:21801528
Update Time:2023-09-11
5-Ethenyl-1-benzothiophene Chemical and Physical Properties
Names and Identifiers
-
- SCHEMBL12113747
- benzo[b]thiophene,5-ethenyl-
- 1033775-44-8
- 5-vinylbenzo[b]thiophene
- Benzo[b]thiophene, 5-ethenyl-
- 5-Ethenyl-1-benzothiophene
-
- Inchi： 1S/C10H8S/c1-2-8-3-4-10-9(7-8)5-6-11-10/h2-7H,1H2
- InChI Key： ISTWCYUBZZSDRK-UHFFFAOYSA-N
- SMILES： S1C=CC2C=C(C=C)C=CC1=2
Computed Properties
- Exact Mass: 160.03467143g/mol
- Monoisotopic Mass: 160.03467143g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 153
- 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: 3.7
- Topological Polar Surface Area: 28.2?2
5-Ethenyl-1-benzothiophene Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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