Home Halogens 1-(2-bromo-5-(trifluoromethyl)phenyl)ethanol

1-(2-bromo-5-(trifluoromethyl)phenyl)ethanol

CAS No.:
1443376-93-9
Catalog Number:
AG01DIBY
Molecular Formula:
C9H8BrF3O
Molecular Weight:
269.0584
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Product Description
Catalog Number:
AG01DIBY
Chemical Name:
1-(2-bromo-5-(trifluoromethyl)phenyl)ethanol
CAS Number:
1443376-93-9
Molecular Formula:
C9H8BrF3O
Molecular Weight:
269.0584
IUPAC Name:
1-[2-bromo-5-(trifluoromethyl)phenyl]ethanol
InChI:
InChI=1S/C9H8BrF3O/c1-5(14)7-4-6(9(11,12)13)2-3-8(7)10/h2-5,14H,1H3
InChI Key:
AUXUUPYNPNIXQA-UHFFFAOYSA-N
SMILES:
CC(c1cc(ccc1Br)C(F)(F)F)O
Properties
Complexity:
195  
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:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties