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2D Structure
Also known as: 66722-57-4, 2-((4-((2-isopropoxyethoxy)methyl)phenoxy)methyl)oxirane, 2-[[4-(2-propan-2-yloxyethoxymethyl)phenoxy]methyl]oxirane, 2-[[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]methyl]oxirane, Oxirane, [[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]methyl]-, 2-[4-(2-isopropoxyethoxymethyl)phenoxymethyl]oxirane
Molecular Formula
C15H22O4
Molecular Weight
266.33  g/mol
InChI Key
RTXODTOQINKROX-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[[4-(2-propan-2-yloxyethoxymethyl)phenoxy]methyl]oxirane
2.1.2 InChI
InChI=1S/C15H22O4/c1-12(2)17-8-7-16-9-13-3-5-14(6-4-13)18-10-15-11-19-15/h3-6,12,15H,7-11H2,1-2H3
2.1.3 InChI Key
RTXODTOQINKROX-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(C)OCCOCC1=CC=C(C=C1)OCC2CO2
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 66722-57-4

2. 2-((4-((2-isopropoxyethoxy)methyl)phenoxy)methyl)oxirane

3. 2-[[4-(2-propan-2-yloxyethoxymethyl)phenoxy]methyl]oxirane

4. 2-[[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]methyl]oxirane

5. Oxirane, [[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]methyl]-

6. 2-[4-(2-isopropoxyethoxymethyl)phenoxymethyl]oxirane

7. Schembl5317097

8. Dtxsid60568313

9. Bcp15724

10. Cs-m2979

11. Akos015900094

12. As-71095

13. Ft-0671767

14. 722m574

15. 1-(p-2-isopropoxyethoxymethylphenoxy)-2,3-epoxypropane

16. 1-[4-(2-isopropoxyethoxymethyl)phenoxy]-2,3-epoxypropane

17. 1-(2,3-epoxypropoxy)-4-[2-(isopropoxy)-ethoxymethyl]-benzene

18. 1-[4-((2-isopropoxyethoxy)methyl)phenoxy]-2,3-epoxypropane

19. 2-[(4-{[2-(propan-2-yloxy)ethoxy]methyl}phenoxy)methyl]oxirane

20. 2-[[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]methyl]-oxirane

21. 2-{[4-({2-[(propan-2-yl)oxy]ethoxy}methyl)phenoxy]methyl}oxirane

2.3 Create Date
2007-02-09
3 Chemical and Physical Properties
Molecular Weight 266.33 g/mol
Molecular Formula C15H22O4
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass266.15180918 g/mol
Monoisotopic Mass266.15180918 g/mol
Topological Polar Surface Area40.2 Ų
Heavy Atom Count19
Formal Charge0
Complexity236
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1