Home Halogens 1-(4-bromo-2-chlorophenyl)-2,2,2-trifluoroethan-1-ol

1-(4-bromo-2-chlorophenyl)-2,2,2-trifluoroethan-1-ol

CAS No.:
1598355-16-8
Catalog Number:
AG01B2R8
Molecular Formula:
C8H5BrClF3O
Molecular Weight:
289.4769
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Product Description
Catalog Number:
AG01B2R8
Chemical Name:
1-(4-bromo-2-chlorophenyl)-2,2,2-trifluoroethan-1-ol
CAS Number:
1598355-16-8
Molecular Formula:
C8H5BrClF3O
Molecular Weight:
289.4769
MDL Number:
MFCD30180441
IUPAC Name:
1-(4-bromo-2-chlorophenyl)-2,2,2-trifluoroethanol
InChI:
InChI=1S/C8H5BrClF3O/c9-4-1-2-5(6(10)3-4)7(14)8(11,12)13/h1-3,7,14H
InChI Key:
YYNHERMFTKJUCF-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)Cl)C(C(F)(F)F)O
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.916g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
289.476g/mol
Monoisotopic Mass:
287.916g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties