Cas no 878140-34-2 (2-[4-(Benzyloxy)phenyl]ethyl octanoate)
![2-[4-(Benzyloxy)phenyl]ethyl octanoate structure](https://ossimg.kuujia.com/scimg/878500/878140-34-2x500.png)
878140-34-2 structure
Product Name:2-[4-(Benzyloxy)phenyl]ethyl octanoate
CAS No:878140-34-2
MF:C23H30O3
MW:354.482507228851
CID:2810810
Update Time:2023-08-07
2-[4-(Benzyloxy)phenyl]ethyl octanoate Chemical and Physical Properties
Names and Identifiers
-
- 2-(4-phenylmethoxyphenyl)ethyl octanoate
- Benzyloxyphenylethyl nonanoate
- 2-[4-(BENZYLOXY)PHENYL]ETHYL OCTANOATE
- 2-[4-(Benzyloxy)phenyl]ethyl octanoate
-
- Inchi： 1S/C23H30O3/c1-2-3-4-5-9-12-23(24)25-18-17-20-13-15-22(16-14-20)26-19-21-10-7-6-8-11-21/h6-8,10-11,13-16H,2-5,9,12,17-19H2,1H3
- InChI Key： MHIIQDMXGSHIMS-UHFFFAOYSA-N
- SMILES： O(CCC1C=CC(=CC=1)OCC1C=CC=CC=1)C(CCCCCCC)=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 26
- Rotatable Bond Count: 13
- Complexity: 355
- XLogP3: 6.5
- Topological Polar Surface Area: 35.5
2-[4-(Benzyloxy)phenyl]ethyl octanoate Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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