Home Other Building Blocks 5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-amine

5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-amine

CAS No.:
198893-71-9
Catalog Number:
AG019V9H
Molecular Formula:
C12H9N3O
Molecular Weight:
211.2194
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Product Description
Catalog Number:
AG019V9H
Chemical Name:
5-(naphthalen-2-yl)-1,3,4-oxadiazol-2-amine
CAS Number:
198893-71-9
Molecular Formula:
C12H9N3O
Molecular Weight:
211.2194
MDL Number:
MFCD09803846
IUPAC Name:
5-naphthalen-2-yl-1,3,4-oxadiazol-2-amine
InChI:
InChI=1S/C12H9N3O/c13-12-15-14-11(16-12)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H2,13,15)
InChI Key:
UNYFQKGWGIABDA-UHFFFAOYSA-N
SMILES:
Nc1nnc(o1)c1ccc2c(c1)cccc2
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.075g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.224g/mol
Monoisotopic Mass:
211.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties