Home Halogens 4-(4-bromophenyl)-1,2-oxazole

4-(4-bromophenyl)-1,2-oxazole

CAS No.:
62893-29-2
Catalog Number:
AG01B8GZ
Molecular Formula:
C9H6BrNO
Molecular Weight:
224.0540
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Product Description
Catalog Number:
AG01B8GZ
Chemical Name:
4-(4-bromophenyl)-1,2-oxazole
CAS Number:
62893-29-2
Molecular Formula:
C9H6BrNO
Molecular Weight:
224.0540
MDL Number:
MFCD22422210
IUPAC Name:
4-(4-bromophenyl)-1,2-oxazole
InChI:
InChI=1S/C9H6BrNO/c10-9-3-1-7(2-4-9)8-5-11-12-6-8/h1-6H
InChI Key:
MBACWFQFZUREBZ-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)c1conc1
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.963g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.057g/mol
Monoisotopic Mass:
222.963g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties