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7788-14-9 | 1,2,4-Oxadiazol-3-amine,5-phenyl-
CAS No: 7788-14-9 Catalog No: AG005EQQ MDL No:MFCD00197235
Product Description
Catalog Number:
AG005EQQ
Chemical Name:
1,2,4-Oxadiazol-3-amine,5-phenyl-
CAS Number:
7788-14-9
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
MDL Number:
MFCD00197235
IUPAC Name:
5-phenyl-1,2,4-oxadiazol-3-amine
InChI:
InChI=1S/C8H7N3O/c9-8-10-7(12-11-8)6-4-2-1-3-5-6/h1-5H,(H2,9,11)
InChI Key:
WEDNOTOHJOGLIK-UHFFFAOYSA-N
SMILES:
Nc1noc(n1)c1ccccc1
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.164g/mol
Monoisotopic Mass:
161.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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