Cas no 112968-89-5 (Benzene, 1-bromo-4-[2-(2-methoxyethoxy)ethoxy]-)
112968-89-5 structure
Product Name:Benzene, 1-bromo-4-[2-(2-methoxyethoxy)ethoxy]-
CAS No:112968-89-5
MF:C11H15BrO3
MW:275.139003038406
CID:1200984
PubChem ID:14026184
Update Time:2025-04-20
Benzene, 1-bromo-4-[2-(2-methoxyethoxy)ethoxy]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-bromo-4-[2-(2-methoxyethoxy)ethoxy]-
- 1-bromo-4-[2-(2-methoxyethoxy)ethoxy]benzene
- DB-179773
- 112968-89-5
- 1-(2-(2-Methoxyethoxy)ethoxy)-4-bromobenzene
- SCHEMBL1928522
- FPSUWMSZOUDIIH-UHFFFAOYSA-N
- AKOS010793536
- 4-[2-(2-methoxyethoxy)ethoxy]bromobenzene
- 1-bromo-4-(2-(2-methoxyethoxy)ethoxy)benzene
- A1-29708
-
- Inchi: 1S/C11H15BrO3/c1-13-6-7-14-8-9-15-11-4-2-10(12)3-5-11/h2-5H,6-9H2,1H3
- InChI Key: FPSUWMSZOUDIIH-UHFFFAOYSA-N
- SMILES: BrC1C=CC(=CC=1)OCCOCCOC
Computed Properties
- Exact Mass: 274.02045
- Monoisotopic Mass: 274.02046g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 7
- Complexity: 147
- 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: 1.8
- Topological Polar Surface Area: 27.7?2
Experimental Properties
- PSA: 27.69
Benzene, 1-bromo-4-[2-(2-methoxyethoxy)ethoxy]- Related Literature
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1. 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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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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