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1421485-28-0 | 5-(7-Ethoxybenzofuran-2-yl)-1,3,4-oxadiazol-2-amine
CAS No: 1421485-28-0 Catalog No: AG01FLSK MDL No:MFCD22587793
Product Description
Catalog Number:
AG01FLSK
Chemical Name:
5-(7-Ethoxybenzofuran-2-yl)-1,3,4-oxadiazol-2-amine
CAS Number:
1421485-28-0
Molecular Formula:
C12H11N3O3
Molecular Weight:
245.2340
MDL Number:
MFCD22587793
IUPAC Name:
5-(7-ethoxy-1-benzofuran-2-yl)-1,3,4-oxadiazol-2-amine
InChI:
InChI=1S/C12H11N3O3/c1-2-16-8-5-3-4-7-6-9(17-10(7)8)11-14-15-12(13)18-11/h3-6H,2H2,1H3,(H2,13,15)
InChI Key:
ADPRNOBYIBYFAH-UHFFFAOYSA-N
SMILES:
CCOc1cccc2c1oc(c2)c1nnc(o1)N
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.08g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.238g/mol
Monoisotopic Mass:
245.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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