Cas no 248603-09-0 (Propanoic acid, 2-bromo-,2,2-bis[(2-bromo-1-oxopropoxy)methyl]-1,3-propanediyl ester)
![Propanoic acid, 2-bromo-,2,2-bis[(2-bromo-1-oxopropoxy)methyl]-1,3-propanediyl ester structure](https://ossimg.kuujia.com/scimg/249000/248603-09-0x500.png)
248603-09-0 structure
Product Name:Propanoic acid, 2-bromo-,2,2-bis[(2-bromo-1-oxopropoxy)methyl]-1,3-propanediyl ester
CAS No:248603-09-0
MF:C17H24Br4O8
MW:675.98366355896
CID:1419859
PubChem ID:20826094
Update Time:2024-11-05
Propanoic acid, 2-bromo-,2,2-bis[(2-bromo-1-oxopropoxy)methyl]-1,3-propanediyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2-bromo-,2,2-bis[(2-bromo-1-oxopropoxy)methyl]-1,3-propanediyl ester
- Propanoic acid, 2-bromo-, 3-(2-bromo-1-oxopropoxy)-2,2-bis[(2-bromo-1-oxopropoxy)methyl]propyl ester
- Tetrakis(2-bromopropanoyloxymethyl)methane
- SCHEMBL138723
- Pentaerythritol Tetrakis(2-bromopropionate)
- [3-(2-bromopropanoyloxy)-2,2-bis(2-bromopropanoyloxymethyl)propyl] 2-bromopropanoate
- 2,2-Bis(((2-bromopropanoyl)oxy)methyl)propane-1,3-diyl bis(2-bromopropanoate)
- 248603-09-0
-
- Inchi： 1S/C17H24Br4O8/c1-9(18)13(22)26-5-17(6-27-14(23)10(2)19,7-28-15(24)11(3)20)8-29-16(25)12(4)21/h9-12H,5-8H2,1-4H3
- InChI Key： QKMPGXHMTXYYRM-UHFFFAOYSA-N
- SMILES： C(OCC(COC(=O)C(Br)C)(COC(=O)C(Br)C)COC(=O)C(Br)C)(=O)C(Br)C
Computed Properties
- Exact Mass: 675.81637g/mol
- Monoisotopic Mass: 671.82047g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 29
- Rotatable Bond Count: 16
- Complexity: 484
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.7
- Topological Polar Surface Area: 105?2
Propanoic acid, 2-bromo-,2,2-bis[(2-bromo-1-oxopropoxy)methyl]-1,3-propanediyl ester Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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