Home Halogens 1-(4-bromophenyl)-3,3,3-trifluoropropan-1-ol

1-(4-bromophenyl)-3,3,3-trifluoropropan-1-ol

CAS No.:
13541-19-0
Catalog Number:
AG01AHDD
Molecular Formula:
C9H8BrF3O
Molecular Weight:
269.0584
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Product Description
Catalog Number:
AG01AHDD
Chemical Name:
1-(4-bromophenyl)-3,3,3-trifluoropropan-1-ol
CAS Number:
13541-19-0
Molecular Formula:
C9H8BrF3O
Molecular Weight:
269.0584
MDL Number:
MFCD12786811
IUPAC Name:
1-(4-bromophenyl)-3,3,3-trifluoropropan-1-ol
InChI:
InChI=1S/C9H8BrF3O/c10-7-3-1-6(2-4-7)8(14)5-9(11,12)13/h1-4,8,14H,5H2
InChI Key:
FWZFEMQGRLKIGH-UHFFFAOYSA-N
SMILES:
OC(c1ccc(cc1)Br)CC(F)(F)F
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.971g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
269.061g/mol
Monoisotopic Mass:
267.971g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties