Cas no 203248-19-5 (Pentanoic acid, 2-[[(4-methoxyphenyl)sulfonyl]methyl]-)
![Pentanoic acid, 2-[[(4-methoxyphenyl)sulfonyl]methyl]- structure](https://ossimg.kuujia.com/scimg/203500/203248-19-5x500.png)
203248-19-5 structure
Product Name:Pentanoic acid, 2-[[(4-methoxyphenyl)sulfonyl]methyl]-
CAS No:203248-19-5
MF:C13H18O5S
MW:286.344023227692
CID:1392222
Update Time:2024-08-16
Pentanoic acid, 2-[[(4-methoxyphenyl)sulfonyl]methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Pentanoic acid, 2-[[(4-methoxyphenyl)sulfonyl]methyl]-
-
- Inchi： 1S/C13H18O5S/c1-3-4-10(13(14)15)9-19(16,17)12-7-5-11(18-2)6-8-12/h5-8,10H,3-4,9H2,1-2H3,(H,14,15)
- InChI Key： ZVZUJPISSVKCNA-UHFFFAOYSA-N
- SMILES： C(O)(=O)C(CS(C1=CC=C(OC)C=C1)(=O)=O)CCC
Computed Properties
- Exact Mass: 286.08754
Experimental Properties
- Density: 1.230±0.06 g/cm3(Predicted)
- Boiling Point: 494.8±45.0 °C(Predicted)
- PSA: 80.67
- pka: 3.92±0.20(Predicted)
Pentanoic acid, 2-[[(4-methoxyphenyl)sulfonyl]methyl]- Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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