Cas no 88961-83-5 (Ethanone, 1-[5-[3-[[(4-methylphenyl)sulfonyl]oxy]propyl]-2-thienyl]-)
88961-83-5 structure
Product Name:Ethanone, 1-[5-[3-[[(4-methylphenyl)sulfonyl]oxy]propyl]-2-thienyl]-
CAS No:88961-83-5
MF:C16H18O4S2
MW:338.441722393036
CID:618089
PubChem ID:71320996
Update Time:2025-04-19
Ethanone, 1-[5-[3-[[(4-methylphenyl)sulfonyl]oxy]propyl]-2-thienyl]- Chemical and Physical Properties
Names and Identifiers
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- Ethanone, 1-[5-[3-[[(4-methylphenyl)sulfonyl]oxy]propyl]-2-thienyl]-
- 3-(5-acetylthiophen-2-yl)propyl 4-methylbenzenesulfonate
- 3-(5-Acetylthiophen-2-yl)propyl 4-methylbenzene-1-sulfonate
- 88961-83-5
- DTXSID60750857
-
- Inchi: 1S/C16H18O4S2/c1-12-5-8-15(9-6-12)22(18,19)20-11-3-4-14-7-10-16(21-14)13(2)17/h5-10H,3-4,11H2,1-2H3
- InChI Key: KUOFNKLUDMGFSO-UHFFFAOYSA-N
- SMILES: S(C1C=CC(C)=CC=1)(=O)(=O)OCCCC1=CC=C(C(C)=O)S1
Computed Properties
- Exact Mass: 338.06465140g/mol
- Monoisotopic Mass: 338.06465140g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 7
- Complexity: 461
- 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: 3.6
- Topological Polar Surface Area: 97.1?2
Ethanone, 1-[5-[3-[[(4-methylphenyl)sulfonyl]oxy]propyl]-2-thienyl]- Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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