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

5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-amine

CAS No.:
23275-52-7
Catalog Number:
AG01B4TI
Molecular Formula:
C9H9N3O2
Molecular Weight:
191.1867
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Product Description
Catalog Number:
AG01B4TI
Chemical Name:
5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-amine
CAS Number:
23275-52-7
Molecular Formula:
C9H9N3O2
Molecular Weight:
191.1867
MDL Number:
MFCD18866908
IUPAC Name:
5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-amine
InChI:
InChI=1S/C9H9N3O2/c1-13-7-4-2-6(3-5-7)8-11-9(10)12-14-8/h2-5H,1H3,(H2,10,12)
InChI Key:
XKJZMTPVMCKYKA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1onc(n1)N
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.069g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.19g/mol
Monoisotopic Mass:
191.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties