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

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

CAS No.:
1423626-90-7
Catalog Number:
AG01A3N2
Molecular Formula:
C10H11N3O2
Molecular Weight:
205.2132
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Product Description
Catalog Number:
AG01A3N2
Chemical Name:
5-(4-methylphenoxymethyl)-1,2,4-oxadiazol-3-amine
CAS Number:
1423626-90-7
Molecular Formula:
C10H11N3O2
Molecular Weight:
205.2132
MDL Number:
MFCD23144030
IUPAC Name:
5-[(4-methylphenoxy)methyl]-1,2,4-oxadiazol-3-amine
InChI:
InChI=1S/C10H11N3O2/c1-7-2-4-8(5-3-7)14-6-9-12-10(11)13-15-9/h2-5H,6H2,1H3,(H2,11,13)
InChI Key:
JJFMGFORHRQKMS-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)OCc1onc(n1)N
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.085g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.217g/mol
Monoisotopic Mass:
205.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties