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

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

CAS No.:
22899-60-1
Catalog Number:
AG019YD6
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
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Product Description
Catalog Number:
AG019YD6
Chemical Name:
4-(3-methylphenyl)-1,2,5-oxadiazol-3-amine
CAS Number:
22899-60-1
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
MDL Number:
MFCD16779596
IUPAC Name:
4-(3-methylphenyl)-1,2,5-oxadiazol-3-amine
InChI:
InChI=1S/C9H9N3O/c1-6-3-2-4-7(5-6)8-9(10)12-13-11-8/h2-5H,1H3,(H2,10,12)
InChI Key:
CUPNWUUGNXKRMY-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)c1nonc1N
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.075g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
175.191g/mol
Monoisotopic Mass:
175.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties