Cas no 1011532-01-6 (Methyl 2-(2-tert-butyl-5-methylphenoxy)acetate)
1011532-01-6 structure
Product Name:Methyl 2-(2-tert-butyl-5-methylphenoxy)acetate
CAS No:1011532-01-6
MF:C14H20O3
MW:236.306804656982
CID:2126436
Update Time:2023-08-04
Methyl 2-(2-tert-butyl-5-methylphenoxy)acetate Chemical and Physical Properties
Names and Identifiers
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- methyl 2-(2-tert-butyl-5-methylphenoxy)acetate
- KSQKHXTZYANBJO-UHFFFAOYSA-N
- Methyl 2-(2-tert-butyl-5-methylphenoxy)acetate
-
- Inchi： 1S/C14H20O3/c1-10-6-7-11(14(2,3)4)12(8-10)17-9-13(15)16-5/h6-8H,9H2,1-5H3
- InChI Key： KSQKHXTZYANBJO-UHFFFAOYSA-N
- SMILES： O(CC(=O)OC)C1C=C(C)C=CC=1C(C)(C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 255
- Topological Polar Surface Area: 35.5
Methyl 2-(2-tert-butyl-5-methylphenoxy)acetate Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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