Cas no 90380-66-8 (Acetic acid, tribromo-, 1,1-dimethylpropyl ester)
90380-66-8 structure
Product Name:Acetic acid, tribromo-, 1,1-dimethylpropyl ester
CAS No:90380-66-8
MF:C7H11Br3O2
MW:366.873040437698
CID:788873
PubChem ID:6432836
Update Time:2025-04-19
Acetic acid, tribromo-, 1,1-dimethylpropyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, tribromo-, 1,1-dimethylpropyl ester
- 2-methylbutan-2-yl 2,2,2-tribromoacetate
- YOEDAVKZAFEGPU-UHFFFAOYSA-N
- Acetic acid, tribromo, 1,1-dimethylpropyl ester
- DTXSID00424126
- 90380-66-8
-
- Inchi： 1S/C7H11Br3O2/c1-4-6(2,3)12-5(11)7(8,9)10/h4H2,1-3H3
- InChI Key： YOEDAVKZAFEGPU-UHFFFAOYSA-N
- SMILES： BrC(C(=O)OC(C)(C)CC)(Br)Br
Computed Properties
- Exact Mass: 365.82887g/mol
- Monoisotopic Mass: 363.83092g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 172
- 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: 3.9
- Topological Polar Surface Area: 26.3?2
Acetic acid, tribromo-, 1,1-dimethylpropyl ester Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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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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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
Related Categories
- Solvents and Organic Chemicals Organic Compounds Organic acids and derivatives Carboxylic acids and derivatives Alpha-halocarboxylic acid derivatives
- Solvents and Organic Chemicals Organic Compounds Organic acids and derivatives Carboxylic acids and derivatives Alpha-halocarboxylic acids and derivatives Alpha-halocarboxylic acid derivatives
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