Cas no 6446-58-8 (1-bromo-2-[2-(4-methoxyphenoxy)ethoxy]-3,5-dimethylbenzene)
![1-bromo-2-[2-(4-methoxyphenoxy)ethoxy]-3,5-dimethylbenzene structure](https://ossimg.kuujia.com/scimg/6500/6446-58-8x500.png)
6446-58-8 structure
Product Name:1-bromo-2-[2-(4-methoxyphenoxy)ethoxy]-3,5-dimethylbenzene
CAS No:6446-58-8
MF:C17H19BrO3
MW:351.234964609146
CID:1679290
PubChem ID:2283505
Update Time:2025-04-21
1-bromo-2-[2-(4-methoxyphenoxy)ethoxy]-3,5-dimethylbenzene Chemical and Physical Properties
Names and Identifiers
-
- 1-bromo-2-[2-(4-methoxyphenoxy)ethoxy]-3,5-dimethylbenzene
- DTXSID90367735
- AKOS002588240
- 6446-58-8
-
- Inchi： 1S/C17H19BrO3/c1-12-10-13(2)17(16(18)11-12)21-9-8-20-15-6-4-14(19-3)5-7-15/h4-7,10-11H,8-9H2,1-3H3
- InChI Key： YIACOEJVZUYCAV-UHFFFAOYSA-N
- SMILES： BrC1=CC(C)=CC(C)=C1OCCOC1C=CC(=CC=1)OC
Computed Properties
- Exact Mass: 350.05177
- Monoisotopic Mass: 350.05176g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 6
- Complexity: 292
- 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: 5
- Topological Polar Surface Area: 27.7?2
Experimental Properties
- PSA: 27.69
1-bromo-2-[2-(4-methoxyphenoxy)ethoxy]-3,5-dimethylbenzene Related Literature
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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