Cas no 5682-08-6 (Thiophene, 2,5-dimethyl-3-phenyl-)
5682-08-6 structure
Product Name:Thiophene, 2,5-dimethyl-3-phenyl-
CAS No:5682-08-6
MF:C12H12S
MW:188.288681983948
CID:347760
PubChem ID:10442482
Update Time:2025-04-19
Thiophene, 2,5-dimethyl-3-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Thiophene, 2,5-dimethyl-3-phenyl-
- DTXSID40439936
- 5682-08-6
- AKOS006321837
- SCHEMBL3423443
-
- Inchi： 1S/C12H12S/c1-9-8-12(10(2)13-9)11-6-4-3-5-7-11/h3-8H,1-2H3
- InChI Key： PRFVRPHTGGFNSR-UHFFFAOYSA-N
- SMILES： S1C(C)=CC(C2C=CC=CC=2)=C1C
Computed Properties
- Exact Mass: 188.06606
- Monoisotopic Mass: 188.06597156g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 161
- 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
- Topological Polar Surface Area: 28.2?2
Experimental Properties
- PSA: 0
Thiophene, 2,5-dimethyl-3-phenyl- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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3. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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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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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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