Home Other Building Blocks 4-(5-butyl-1,2,4-oxadiazol-3-yl)phenol

4-(5-butyl-1,2,4-oxadiazol-3-yl)phenol

CAS No.:
10185-79-2
Catalog Number:
AG019X31
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
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Product Description
Catalog Number:
AG019X31
Chemical Name:
4-(5-butyl-1,2,4-oxadiazol-3-yl)phenol
CAS Number:
10185-79-2
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
MDL Number:
MFCD10691947
IUPAC Name:
4-(5-butyl-1,2,4-oxadiazol-3-yl)phenol
InChI:
InChI=1S/C12H14N2O2/c1-2-3-4-11-13-12(14-16-11)9-5-7-10(15)8-6-9/h5-8,15H,2-4H2,1H3
InChI Key:
OUNWDZINNLJSJW-UHFFFAOYSA-N
SMILES:
CCCCc1onc(n1)c1ccc(cc1)O
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties