Cas no 15545-99-0 (2-Ethylhexyl 6-hydroxyhexanoate)
15545-99-0 structure
Product Name:2-Ethylhexyl 6-hydroxyhexanoate
CAS No:15545-99-0
MF:C14H28O3
MW:244.370325088501
CID:2779469
PubChem ID:14401738
Update Time:2025-04-21
2-Ethylhexyl 6-hydroxyhexanoate Chemical and Physical Properties
Names and Identifiers
-
- 15545-99-0
- DTXSID70559873
- 2-ETHYLHEXYL 6-HYDROXYHEXANOATE
- DTXSID301184874
- 117172-23-3
- SCHEMBL9789711
- Poly[oxy(1-oxo-1,6-hexanediyl)], I+/--(2-ethylhexyl)-I-hydroxy-
- 2-Ethylhexyl 6-hydroxyhexanoate
-
- Inchi： 1S/C14H28O3/c1-3-5-9-13(4-2)12-17-14(16)10-7-6-8-11-15/h13,15H,3-12H2,1-2H3
- InChI Key： IOEZZIWCAHIMFC-UHFFFAOYSA-N
- SMILES： O(C(CCCCCO)=O)CC(CC)CCCC
Computed Properties
- Exact Mass: 244.20384475Da
- Monoisotopic Mass: 244.20384475Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 12
- Complexity: 180
- 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: 3.6
- Topological Polar Surface Area: 46.5?2
2-Ethylhexyl 6-hydroxyhexanoate Related Literature
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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