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75746-33-7 | Oxirane, [(2-iodophenoxy)methyl]-
CAS No: 75746-33-7 Catalog No: AG005UZL MDL No:
Product Description
Catalog Number:
AG005UZL
Chemical Name:
Oxirane, [(2-iodophenoxy)methyl]-
CAS Number:
75746-33-7
Molecular Formula:
C9H9IO2
Molecular Weight:
276.0710
IUPAC Name:
2-[(2-iodophenoxy)methyl]oxirane
InChI:
InChI=1S/C9H9IO2/c10-8-3-1-2-4-9(8)12-6-7-5-11-7/h1-4,7H,5-6H2
InChI Key:
DCTQHUBQXSEMEW-UHFFFAOYSA-N
SMILES:
Ic1ccccc1OCC1CO1
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.965g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.073g/mol
Monoisotopic Mass:
275.965g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Copper-catalyzed tandem process: an efficient approach to 2-substituted-1,4-benzodioxanes. | Organic & biomolecular chemistry 20100621 |
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