Home Halogens 3-(4-bromophenyl)-5-ethyl-1,2-oxazole-4-carboxylic acid

3-(4-bromophenyl)-5-ethyl-1,2-oxazole-4-carboxylic acid

CAS No.:
1463808-08-3
Catalog Number:
AG01BGUX
Molecular Formula:
C12H10BrNO3
Molecular Weight:
296.1167
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Product Description
Catalog Number:
AG01BGUX
Chemical Name:
3-(4-bromophenyl)-5-ethyl-1,2-oxazole-4-carboxylic acid
CAS Number:
1463808-08-3
Molecular Formula:
C12H10BrNO3
Molecular Weight:
296.1167
MDL Number:
MFCD19092951
IUPAC Name:
3-(4-bromophenyl)-5-ethyl-1,2-oxazole-4-carboxylic acid
InChI:
InChI=1S/C12H10BrNO3/c1-2-9-10(12(15)16)11(14-17-9)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H,15,16)
InChI Key:
ANMFUNGTCLXWGH-UHFFFAOYSA-N
SMILES:
CCc1onc(c1C(=O)O)c1ccc(cc1)Br
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.984g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.12g/mol
Monoisotopic Mass:
294.984g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties