Home Other Building Blocks 2-N-benzyl-1,3,4-oxadiazole-2,5-diamine

2-N-benzyl-1,3,4-oxadiazole-2,5-diamine

CAS No.:
90558-69-3
Catalog Number:
AG01BD50
Molecular Formula:
C9H10N4O
Molecular Weight:
190.2019
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Product Description
Catalog Number:
AG01BD50
Chemical Name:
2-N-benzyl-1,3,4-oxadiazole-2,5-diamine
CAS Number:
90558-69-3
Molecular Formula:
C9H10N4O
Molecular Weight:
190.2019
MDL Number:
MFCD20705546
IUPAC Name:
2-N-benzyl-1,3,4-oxadiazole-2,5-diamine
InChI:
InChI=1S/C9H10N4O/c10-8-12-13-9(14-8)11-6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,10,12)(H,11,13)
InChI Key:
GHUNXWZWFGGJJR-UHFFFAOYSA-N
SMILES:
Nc1nnc(o1)NCc1ccccc1
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.085g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
190.206g/mol
Monoisotopic Mass:
190.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
77A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties