CAS 5296-35-5

1 2D Structure

CAS 5296-35-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-[(2-ethoxyphenoxy)methyl]oxirane

2.1.2 InChI

InChI=1S/C11H14O3/c1-2-12-10-5-3-4-6-11(10)14-8-9-7-13-9/h3-6,9H,2,7-8H2,1H3

2.1.3 InChI Key

DJOGZXNBSUIGKG-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC1=CC=CC=C1OCC2CO2

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 5296-35-5

2. 2-[(2-ethoxyphenoxy)methyl]oxirane

3. 1-(2-ethoxyphenoxy)-2,3-epoxypropane

4. 2-((2-ethoxyphenoxy)methyl)oxirane

5. 2-ethoxyphenyl Glycidyl Ether

6. Starbld0044265

7. Schembl1698264

8. Djogzxnbsuigkg-uhfffaoysa-n

9. Dtxsid301297673

10. Akos000192213

11. Akos017283024

12. 3-(2-ethoxyphenoxy)-1,2-epoxypropane

13. Ft-0668114

2.3 Create Date

2007-02-08

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₄O₃
Molecular Weight	194.23 g/mol
XLogP3	1.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	31
Heavy Atom Count	14
Formal Charge	0
Complexity	172
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

CAS 5296-35-5 manufacturers and suppliers on PharmaCompass