Home Other Building Blocks 3-(phenoxymethyl)-N-(propan-2-yl)-1,2,4-oxadiazol-5-amine

3-(phenoxymethyl)-N-(propan-2-yl)-1,2,4-oxadiazol-5-amine

CAS No.:
1271566-09-6
Catalog Number:
AG01A2LX
Molecular Formula:
C12H15N3O2
Molecular Weight:
233.2664
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Product Description
Catalog Number:
AG01A2LX
Chemical Name:
3-(phenoxymethyl)-N-(propan-2-yl)-1,2,4-oxadiazol-5-amine
CAS Number:
1271566-09-6
Molecular Formula:
C12H15N3O2
Molecular Weight:
233.2664
MDL Number:
MFCD17376906
IUPAC Name:
3-(phenoxymethyl)-N-propan-2-yl-1,2,4-oxadiazol-5-amine
InChI:
InChI=1S/C12H15N3O2/c1-9(2)13-12-14-11(15-17-12)8-16-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,13,14,15)
InChI Key:
OBPQTOSUZWEIMP-UHFFFAOYSA-N
SMILES:
CC(Nc1onc(n1)COc1ccccc1)C
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.116g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.271g/mol
Monoisotopic Mass:
233.116g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties