Cas no 649740-10-3 (Thiophene, 2,5-bis(1,1-dimethylpropyl)-)
649740-10-3 structure
Product Name:Thiophene, 2,5-bis(1,1-dimethylpropyl)-
CAS No:649740-10-3
MF:C14H24S
MW:224.405363082886
CID:410220
PubChem ID:23576692
Update Time:2025-04-19
Thiophene, 2,5-bis(1,1-dimethylpropyl)- Chemical and Physical Properties
Names and Identifiers
-
- Thiophene, 2,5-bis(1,1-dimethylpropyl)-
- 2,5-bis(2-methylbutan-2-yl)thiophene
- 649740-10-3
- DTXSID30635041
- 2,5-di-t-amylthiophene
- SCHEMBL10049581
-
- Inchi： 1S/C14H24S/c1-7-13(3,4)11-9-10-12(15-11)14(5,6)8-2/h9-10H,7-8H2,1-6H3
- InChI Key： NABWLJOEZZWBCB-UHFFFAOYSA-N
- SMILES： S1C(=CC=C1C(C)(C)CC)C(C)(C)CC
Computed Properties
- Exact Mass: 224.16002
- Monoisotopic Mass: 224.15987194g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 183
- 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: 5.7
- Topological Polar Surface Area: 28.2?2
Experimental Properties
- PSA: 0
Thiophene, 2,5-bis(1,1-dimethylpropyl)- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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