Cas no 2149601-12-5 (5-Bromo-2-(difluoromethoxy)phenacyl bromide)
2149601-12-5 structure
Product Name:5-Bromo-2-(difluoromethoxy)phenacyl bromide
CAS No:2149601-12-5
MF:C9H6Br2F2O2
MW:343.947548389435
CID:4711144
Update Time:2023-08-16
5-Bromo-2-(difluoromethoxy)phenacyl bromide Chemical and Physical Properties
Names and Identifiers
-
- 5-Bromo-2-(difluoromethoxy)phenacyl bromide
-
- Inchi： 1S/C9H6Br2F2O2/c10-4-7(14)6-3-5(11)1-2-8(6)15-9(12)13/h1-3,9H,4H2
- InChI Key： CWTAQJZBUJMNNY-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=C(C(CBr)=O)C=1)OC(F)F
Computed Properties
- Exact Mass: 343.86821 g/mol
- Monoisotopic Mass: 341.87026 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 226
- 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
- Molecular Weight: 343.95
- XLogP3: 4
- Topological Polar Surface Area: 26.3
5-Bromo-2-(difluoromethoxy)phenacyl bromide Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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