Cas no 14779-95-4 (2,6-Dimethyloctyl palmitate)
2,6-Dimethyloctyl palmitate structure
Product Name:2,6-Dimethyloctyl palmitate
CAS No:14779-95-4
MF:C26H52O2
MW:396.689888954163
CID:2778371
Update Time:2023-08-07
2,6-Dimethyloctyl palmitate Chemical and Physical Properties
Names and Identifiers
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- 2,6-Dimethyloctyl palmitate
-
- Inchi： 1S/C26H52O2/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-22-26(27)28-23-25(4)21-19-20-24(3)6-2/h24-25H,5-23H2,1-4H3
- InChI Key： RSMUNTPTGGBNBU-UHFFFAOYSA-N
- SMILES： O(C(CCCCCCCCCCCCCCC)=O)CC(C)CCCC(C)CC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 28
- Rotatable Bond Count: 22
- Complexity: 326
- XLogP3: 11.5
- Topological Polar Surface Area: 26.3
2,6-Dimethyloctyl palmitate Related Literature
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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