Cas no 89552-59-0 (Propanoic acid, 3-[(4-ethenylphenyl)sulfonyl]-)
![Propanoic acid, 3-[(4-ethenylphenyl)sulfonyl]- structure](https://ossimg.kuujia.com/scimg/90000/89552-59-0x500.png)
89552-59-0 structure
Product Name:Propanoic acid, 3-[(4-ethenylphenyl)sulfonyl]-
CAS No:89552-59-0
MF:C11H12O4S
MW:240.275582313538
CID:596802
PubChem ID:12683175
Update Time:2025-04-19
Propanoic acid, 3-[(4-ethenylphenyl)sulfonyl]- Chemical and Physical Properties
Names and Identifiers
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- Propanoic acid, 3-[(4-ethenylphenyl)sulfonyl]-
- 3-(4-ethenylphenyl)sulfonylpropanoic acid
- 3-(4-Ethenylbenzene-1-sulfonyl)propanoic acid
- SCHEMBL11050771
- 89552-59-0
- DTXSID70506781
-
- Inchi： 1S/C11H12O4S/c1-2-9-3-5-10(6-4-9)16(14,15)8-7-11(12)13/h2-6H,1,7-8H2,(H,12,13)
- InChI Key： XBCDXSISVJKRHL-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C=C)=CC=1)(CCC(=O)O)(=O)=O
Computed Properties
- Exact Mass: 240.04563003g/mol
- Monoisotopic Mass: 240.04563003g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 345
- 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: 1.4
- Topological Polar Surface Area: 79.8?2
Propanoic acid, 3-[(4-ethenylphenyl)sulfonyl]- Related Literature
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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