Home Halogens 5-(bromomethyl)-3-(trifluoromethyl)-1,2-oxazole

5-(bromomethyl)-3-(trifluoromethyl)-1,2-oxazole

CAS No.:
1364677-98-4
Catalog Number:
AG01BV0N
Molecular Formula:
C5H3BrF3NO
Molecular Weight:
229.9826
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Product Description
Catalog Number:
AG01BV0N
Chemical Name:
5-(bromomethyl)-3-(trifluoromethyl)-1,2-oxazole
CAS Number:
1364677-98-4
Molecular Formula:
C5H3BrF3NO
Molecular Weight:
229.9826
MDL Number:
MFCD23162061
IUPAC Name:
5-(bromomethyl)-3-(trifluoromethyl)-1,2-oxazole
InChI:
InChI=1S/C5H3BrF3NO/c6-2-3-1-4(10-11-3)5(7,8)9/h1H,2H2
InChI Key:
BXYNYIBFDBYBQL-UHFFFAOYSA-N
SMILES:
BrCc1onc(c1)C(F)(F)F
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.935g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.984g/mol
Monoisotopic Mass:
228.935g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties