Home Halogens Ethanone, 1-(4-bromophenyl)-2-fluoro- (9CI)

Ethanone, 1-(4-bromophenyl)-2-fluoro- (9CI)

CAS No.:
403-30-5
Catalog Number:
AG00CTOK
Molecular Formula:
C8H6BrFO
Molecular Weight:
217.0350
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Product Description
Catalog Number:
AG00CTOK
Chemical Name:
Ethanone, 1-(4-bromophenyl)-2-fluoro- (9CI)
CAS Number:
403-30-5
Molecular Formula:
C8H6BrFO
Molecular Weight:
217.0350
MDL Number:
MFCD13173359
IUPAC Name:
1-(4-bromophenyl)-2-fluoroethanone
InChI:
InChI=1S/C8H6BrFO/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4H,5H2
InChI Key:
PATCUTBZBAERHM-UHFFFAOYSA-N
SMILES:
FCC(=O)c1ccc(cc1)Br
Properties
Complexity:
141  
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:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties