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71006-77-4 | 1-(2-phenoxyethyl)-2-nitroimidazole
CAS No: 71006-77-4 Catalog No: AG00FUIR MDL No:
Product Description
Catalog Number:
AG00FUIR
Chemical Name:
1-(2-phenoxyethyl)-2-nitroimidazole
CAS Number:
71006-77-4
IUPAC Name:
2-nitro-1-(2-phenoxyethyl)imidazole
InChI:
InChI=1S/C11H11N3O3/c15-14(16)11-12-6-7-13(11)8-9-17-10-4-2-1-3-5-10/h1-7H,8-9H2
InChI Key:
WABAZVBPBXWHRN-UHFFFAOYSA-N
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.08g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.227g/mol
Monoisotopic Mass:
233.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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