Home Other Building Blocks 1,3,4-Oxadiazol-2-amine, 5-(2-phenylethyl)-

1,3,4-Oxadiazol-2-amine, 5-(2-phenylethyl)-

CAS No.:
1617-93-2
Catalog Number:
AG001VT8
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
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Product Description
Catalog Number:
AG001VT8
Chemical Name:
1,3,4-Oxadiazol-2-amine, 5-(2-phenylethyl)-
CAS Number:
1617-93-2
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
MDL Number:
MFCD09814682
IUPAC Name:
5-(2-phenylethyl)-1,3,4-oxadiazol-2-amine
InChI:
InChI=1S/C10H11N3O/c11-10-13-12-9(14-10)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,11,13)
InChI Key:
HOUJXRMAYWZMHT-UHFFFAOYSA-N
SMILES:
Nc1nnc(o1)CCc1ccccc1
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:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties