Home Halogens 1-(5-bromo-2-fluorophenyl)-2,2,2-trifluoroethan-1-ol

1-(5-bromo-2-fluorophenyl)-2,2,2-trifluoroethan-1-ol

CAS No.:
1039827-16-1
Catalog Number:
AG01ABDC
Molecular Formula:
C8H5BrF4O
Molecular Weight:
273.0223
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Product Description
Catalog Number:
AG01ABDC
Chemical Name:
1-(5-bromo-2-fluorophenyl)-2,2,2-trifluoroethan-1-ol
CAS Number:
1039827-16-1
Molecular Formula:
C8H5BrF4O
Molecular Weight:
273.0223
MDL Number:
MFCD16067891
IUPAC Name:
1-(5-bromo-2-fluorophenyl)-2,2,2-trifluoroethanol
InChI:
InChI=1S/C8H5BrF4O/c9-4-1-2-6(10)5(3-4)7(14)8(11,12)13/h1-3,7,14H
InChI Key:
FRYOXCMTJUDLMZ-UHFFFAOYSA-N
SMILES:
OC(C(F)(F)F)c1cc(Br)ccc1F
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.946g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
273.025g/mol
Monoisotopic Mass:
271.946g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties