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

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

CAS No.:
500867-13-0
Catalog Number:
AG019UMJ
Molecular Formula:
C13H11N3O
Molecular Weight:
225.2459
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Product Description
Catalog Number:
AG019UMJ
Chemical Name:
5-(naphthalen-1-ylmethyl)-1,3,4-oxadiazol-2-amine
CAS Number:
500867-13-0
Molecular Formula:
C13H11N3O
Molecular Weight:
225.2459
MDL Number:
MFCD02671875
IUPAC Name:
5-(naphthalen-1-ylmethyl)-1,3,4-oxadiazol-2-amine
InChI:
InChI=1S/C13H11N3O/c14-13-16-15-12(17-13)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H2,14,16)
InChI Key:
MHVBKEOAWZXBES-UHFFFAOYSA-N
SMILES:
Nc1nnc(o1)Cc1cccc2c1cccc2
NSC Number:
614444
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.09g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.251g/mol
Monoisotopic Mass:
225.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties