Home Other Building Blocks (1S)-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethan-1-ol

(1S)-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethan-1-ol

CAS No.:
1567666-58-3
Catalog Number:
AG01EMPL
Molecular Formula:
C9H8F4O
Molecular Weight:
208.1528
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Product Description
Catalog Number:
AG01EMPL
Chemical Name:
(1S)-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethan-1-ol
CAS Number:
1567666-58-3
Molecular Formula:
C9H8F4O
Molecular Weight:
208.1528
MDL Number:
MFCD31667946
IUPAC Name:
(1S)-1-[3-fluoro-5-(trifluoromethyl)phenyl]ethanol
InChI:
InChI=1S/C9H8F4O/c1-5(14)6-2-7(9(11,12)13)4-8(10)3-6/h2-5,14H,1H3/t5-/m0/s1
InChI Key:
XODJGUXJHGDPTL-YFKPBYRVSA-N
SMILES:
Fc1cc(cc(c1)C(F)(F)F)[C@@H](O)C
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
208.051g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.156g/mol
Monoisotopic Mass:
208.051g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties