CAS 3259-03-8

1 2D Structure

CAS 3259-03-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-(2-bromoethoxy)-2-ethoxybenzene

2.1.2 InChI

InChI=1S/C10H13BrO2/c1-2-12-9-5-3-4-6-10(9)13-8-7-11/h3-6H,2,7-8H2,1H3

2.1.3 InChI Key

IOYHGBZPUZBUTJ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC1=CC=CC=C1OCCBr

2.2 Other Identifiers

2.2.1 UNII

GMJ3274102

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 2-(2-ethoxyphenoxy)ethyl Bromide

2. 3259-03-8

3. 2-(2-ethoxyphenoxy)ethylbromide

4. Benzene, 1-(2-bromoethoxy)-2-ethoxy-

5. 1-(2-bromoethoxy)-2-ethyoxybenzene

6. Mfcd02030483

7. Gmj3274102

8. 2-(2-bromoethoxy)phenetole

9. 1-(2-bromoethoxy)-2-ethoxy-benzene

10. Tamsulosin Impurity I

11. Ethyl4-boronocinnamate

12. Schembl1412326

13. 2-(o-ethoxyphenoxy)ethylbromide

14. Unii-gmj3274102

15. 2-(o-ethoxyphenoxy)ethyl Bromide

16. Dtxsid10186283

17. Amy31226

18. Zinc2388622

19. Akos000164018

20. Ac-5615

21. Cs-w002871

22. Ds-1212

23. Sy030339

24. B3191

25. Ft-0634750

26. En300-93023

27. 259e038

28. Q27279176

29. Tamsulosin Hydrochloride Impurity I [ep Impurity]

30. 1-(2-bromoethoxy)-2-ethoxybenzene;2-(2-bromoethoxy)phenetole

2.4 Create Date

2006-07-29

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₃BrO₂
Molecular Weight	245.11 g/mol
XLogP3	2.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	5
Exact Mass	244.00989 g/mol
Monoisotopic Mass	244.00989 g/mol
Topological Polar Surface Area	18.5 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	130
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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CAS 3259-03-8

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