Cas no 83320-96-1 (5-Undecanone, 2-(acetyloxy)-)
5-Undecanone, 2-(acetyloxy)- structure
Product Name:5-Undecanone, 2-(acetyloxy)-
CAS No:83320-96-1
MF:C13H24O3
MW:228.327864646912
CID:1807885
PubChem ID:12807122
Update Time:2025-04-21
5-Undecanone, 2-(acetyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- 5-Undecanone, 2-(acetyloxy)-
- 5-oxoundecan-2-yl acetate
- 2-acetoxy-5-undecanone
- DTXSID80510334
- 83320-96-1
- SCHEMBL4936658
-
- Inchi： 1S/C13H24O3/c1-4-5-6-7-8-13(15)10-9-11(2)16-12(3)14/h11H,4-10H2,1-3H3
- InChI Key： GKZSXLROJBIKKD-UHFFFAOYSA-N
- SMILES： CCCCCCC(CCC(OC(=O)C)C)=O
Computed Properties
- Exact Mass: 228.17254462g/mol
- Monoisotopic Mass: 228.17254462g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 10
- Complexity: 211
- 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
- Topological Polar Surface Area: 43.4?2
5-Undecanone, 2-(acetyloxy)- Related Literature
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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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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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