Home Other Building Blocks 5-BROMO-3-ETHYL-ISOXAZOLE

5-BROMO-3-ETHYL-ISOXAZOLE

CAS No.:
1314961-74-4
Catalog Number:
AG01DV90
Molecular Formula:
C5H6BrNO
Molecular Weight:
176.0112
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Product Description
Catalog Number:
AG01DV90
Chemical Name:
5-BROMO-3-ETHYL-ISOXAZOLE
CAS Number:
1314961-74-4
Molecular Formula:
C5H6BrNO
Molecular Weight:
176.0112
MDL Number:
MFCD11216978
IUPAC Name:
5-bromo-3-ethyl-1,2-oxazole
InChI:
InChI=1S/C5H6BrNO/c1-2-4-3-5(6)8-7-4/h3H,2H2,1H3
InChI Key:
WANFRXIDECYPGJ-UHFFFAOYSA-N
SMILES:
CCc1cc(on1)Br
Properties
Complexity:
78.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.963g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.013g/mol
Monoisotopic Mass:
174.963g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties