Cas no 114927-87-6 (ethyl 8-oxooctadecanoate)
ethyl 8-oxooctadecanoate structure
Product Name:ethyl 8-oxooctadecanoate
CAS No:114927-87-6
MF:C20H38O3
MW:326.51392698288
CID:2613412
PubChem ID:14211917
Update Time:2025-04-21
ethyl 8-oxooctadecanoate Chemical and Physical Properties
Names and Identifiers
-
- ethyl 8-oxooctadecanoate
- DTXSID60557484
- 114927-87-6
-
- Inchi： 1S/C20H38O3/c1-3-5-6-7-8-9-10-13-16-19(21)17-14-11-12-15-18-20(22)23-4-2/h3-18H2,1-2H3
- InChI Key： QNKQKFDOASBKGL-UHFFFAOYSA-N
- SMILES： O=C(CCCCCCC(=O)OCC)CCCCCCCCCC
Computed Properties
- Exact Mass: 326.28209507Da
- Monoisotopic Mass: 326.28209507Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 23
- Rotatable Bond Count: 18
- Complexity: 287
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6.5
- Topological Polar Surface Area: 43.4?2
ethyl 8-oxooctadecanoate Related Literature
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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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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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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