Cas no 62402-50-0 (Propanoic acid, 2-methyl-2-[4-(1-phenylethyl)phenoxy]-, ethyl ester)
![Propanoic acid, 2-methyl-2-[4-(1-phenylethyl)phenoxy]-, ethyl ester structure](https://ossimg.kuujia.com/scimg/62500/62402-50-0x500.png)
62402-50-0 structure
Product Name:Propanoic acid, 2-methyl-2-[4-(1-phenylethyl)phenoxy]-, ethyl ester
CAS No:62402-50-0
MF:C20H24O3
MW:312.402766227722
CID:446033
PubChem ID:12346116
Update Time:2025-04-19
Propanoic acid, 2-methyl-2-[4-(1-phenylethyl)phenoxy]-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2-methyl-2-[4-(1-phenylethyl)phenoxy]-, ethyl ester
- ethyl 2-methyl-2-[4-(1-phenylethyl)phenoxy]propanoate
- DTXSID00492769
- 62402-50-0
-
- Inchi： 1S/C20H24O3/c1-5-22-19(21)20(3,4)23-18-13-11-17(12-14-18)15(2)16-9-7-6-8-10-16/h6-15H,5H2,1-4H3
- InChI Key： LDYFHWUJBRNKCI-UHFFFAOYSA-N
- SMILES： O(C1C=CC(=CC=1)C(C)C1C=CC=CC=1)C(C(=O)OCC)(C)C
Computed Properties
- Exact Mass: 312.17262
- Monoisotopic Mass: 312.17254462g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 23
- Rotatable Bond Count: 7
- Complexity: 363
- 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
- XLogP3: 5
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
Propanoic acid, 2-methyl-2-[4-(1-phenylethyl)phenoxy]-, ethyl ester Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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