Home Halogens 2-(3-bromo-4-fluorophenyl)oxirane

2-(3-bromo-4-fluorophenyl)oxirane

CAS No.:
1486225-67-5
Catalog Number:
AG01AD2X
Molecular Formula:
C8H6BrFO
Molecular Weight:
217.0350
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Product Description
Catalog Number:
AG01AD2X
Chemical Name:
2-(3-bromo-4-fluorophenyl)oxirane
CAS Number:
1486225-67-5
Molecular Formula:
C8H6BrFO
Molecular Weight:
217.0350
MDL Number:
MFCD17242224
IUPAC Name:
2-(3-bromo-4-fluorophenyl)oxirane
InChI:
InChI=1S/C8H6BrFO/c9-6-3-5(8-4-11-8)1-2-7(6)10/h1-3,8H,4H2
InChI Key:
KGZGYLSAJXQGND-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1Br)C1CO1
Properties
Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.959g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.037g/mol
Monoisotopic Mass:
215.959g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties