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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

CAS 66722-57-4
1 2D Structure

CAS 66722-57-4

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

BUILDING BLOCK

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