Cas no 6446-44-2 (2-bromo-1-[3-(4-ethoxyphenoxy)propoxy]-4-methylbenzene)
![2-bromo-1-[3-(4-ethoxyphenoxy)propoxy]-4-methylbenzene structure](https://ossimg.kuujia.com/scimg/6500/6446-44-2x500.png)
6446-44-2 structure
Product Name:2-bromo-1-[3-(4-ethoxyphenoxy)propoxy]-4-methylbenzene
CAS No:6446-44-2
MF:C18H21BrO3
MW:365.261544942856
CID:1678869
PubChem ID:2283499
Update Time:2025-04-21
2-bromo-1-[3-(4-ethoxyphenoxy)propoxy]-4-methylbenzene Chemical and Physical Properties
Names and Identifiers
-
- 2-bromo-1-[3-(4-ethoxyphenoxy)propoxy]-4-methylbenzene
- DTXSID70367733
- 6446-44-2
-
- Inchi： 1S/C18H21BrO3/c1-3-20-15-6-8-16(9-7-15)21-11-4-12-22-18-10-5-14(2)13-17(18)19/h5-10,13H,3-4,11-12H2,1-2H3
- InChI Key： SJEDJCVNVHEQCQ-UHFFFAOYSA-N
- SMILES： BrC1C=C(C)C=CC=1OCCCOC1C=CC(=CC=1)OCC
Computed Properties
- Exact Mass: 364.06743
- Monoisotopic Mass: 364.067
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 22
- Rotatable Bond Count: 8
- 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: 5.3
- Topological Polar Surface Area: 27.7?2
Experimental Properties
- Density: 1.269
- Boiling Point: 452.1°C at 760 mmHg
- Flash Point: 188°C
- Refractive Index: 1.554
- PSA: 27.69
2-bromo-1-[3-(4-ethoxyphenoxy)propoxy]-4-methylbenzene Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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