Home Halogens 2-bromo-5-(4-methoxyphenyl)-1,3,4-oxadiazole

2-bromo-5-(4-methoxyphenyl)-1,3,4-oxadiazole

CAS No.:
1368483-63-9
Catalog Number:
AG009WK2
Molecular Formula:
C9H7BrN2O2
Molecular Weight:
255.0681
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Product Description
Catalog Number:
AG009WK2
Chemical Name:
2-bromo-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CAS Number:
1368483-63-9
Molecular Formula:
C9H7BrN2O2
Molecular Weight:
255.0681
MDL Number:
MFCD21898550
IUPAC Name:
2-bromo-5-(4-methoxyphenyl)-1,3,4-oxadiazole
InChI:
InChI=1S/C9H7BrN2O2/c1-13-7-4-2-6(3-5-7)8-11-12-9(10)14-8/h2-5H,1H3
InChI Key:
OXBLGMQKKFGHTI-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1nnc(o1)Br
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.969g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.071g/mol
Monoisotopic Mass:
253.969g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
48.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties