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1617-98-7 | 1,3,4-Oxadiazol-2-amine, N-ethyl-5-phenyl-
CAS No: 1617-98-7 Catalog No: AG001VUE MDL No:
Product Description
Catalog Number:
AG001VUE
Chemical Name:
1,3,4-Oxadiazol-2-amine, N-ethyl-5-phenyl-
CAS Number:
1617-98-7
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
IUPAC Name:
N-ethyl-5-phenyl-1,3,4-oxadiazol-2-amine
InChI:
InChI=1S/C10H11N3O/c1-2-11-10-13-12-9(14-10)8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,11,13)
InChI Key:
VDSZQXWRCBMVKX-UHFFFAOYSA-N
SMILES:
CCNc1nnc(o1)c1ccccc1
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.218g/mol
Monoisotopic Mass:
189.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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