Cas no 89102-40-9 (2-Decanone, 10-(acetyloxy)-1-bromo-)
89102-40-9 structure
Product Name:2-Decanone, 10-(acetyloxy)-1-bromo-
CAS No:89102-40-9
MF:C12H21BrO3
MW:293.197343587875
CID:612235
PubChem ID:19995235
Update Time:2025-04-19
2-Decanone, 10-(acetyloxy)-1-bromo- Chemical and Physical Properties
Names and Identifiers
-
- 2-Decanone, 10-(acetyloxy)-1-bromo-
- (10-bromo-9-oxodecyl) acetate
- 10-bromo-9-oxodecyl acetate
- DTXSID20601755
- 89102-40-9
- WSCNJHWZOOVLLJ-UHFFFAOYSA-N
- SCHEMBL9863320
-
- Inchi: 1S/C12H21BrO3/c1-11(14)16-9-7-5-3-2-4-6-8-12(15)10-13/h2-10H2,1H3
- InChI Key: WSCNJHWZOOVLLJ-UHFFFAOYSA-N
- SMILES: BrCC(CCCCCCCCOC(C)=O)=O
Computed Properties
- Exact Mass: 292.06741g/mol
- Monoisotopic Mass: 292.06741g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 11
- Complexity: 204
- 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: 3.3
- Topological Polar Surface Area: 43.4?2
2-Decanone, 10-(acetyloxy)-1-bromo- Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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