Cas no 92723-58-5 (Propanoic acid, 2-methyl-3-[(4-methylphenyl)sulfonyl]-, methyl ester)
![Propanoic acid, 2-methyl-3-[(4-methylphenyl)sulfonyl]-, methyl ester structure](https://ossimg.kuujia.com/scimg/93000/92723-58-5x500.png)
92723-58-5 structure
Product Name:Propanoic acid, 2-methyl-3-[(4-methylphenyl)sulfonyl]-, methyl ester
CAS No:92723-58-5
MF:C12H16O4S
MW:256.318042755127
CID:753048
Update Time:2023-08-03
Propanoic acid, 2-methyl-3-[(4-methylphenyl)sulfonyl]-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2-methyl-3-[(4-methylphenyl)sulfonyl]-, methyl ester
- methyl 2-methyl-3-(4-methylphenyl)sulfonylpropanoate
- methyl 2-methyl-3-(p-tolylsulfonyl)propanoate
- 3-(p-Tolylsulfonyl)-2-methylpropanoic acid methyl ester
- Methyl 2-methyl-3-(4-methylbenzene-1-sulfonyl)propanoate
-
- Inchi： 1S/C12H16O4S/c1-9-4-6-11(7-5-9)17(14,15)8-10(2)12(13)16-3/h4-7,10H,8H2,1-3H3
- InChI Key： ABJISGAJTYFARS-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C)=CC=1)(CC(C(=O)OC)C)(=O)=O
Computed Properties
- Exact Mass: 256.077
- Monoisotopic Mass: 256.077
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 347
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 68.8
Propanoic acid, 2-methyl-3-[(4-methylphenyl)sulfonyl]-, methyl ester Related Literature
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
92723-58-5 (Propanoic acid, 2-methyl-3-[(4-methylphenyl)sulfonyl]-, methyl ester) Related Products
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