Home Other Building Blocks 1-[2-hydroxy-4-(trifluoromethyl)phenyl]propan-1-one

1-[2-hydroxy-4-(trifluoromethyl)phenyl]propan-1-one

CAS No.:
1261680-31-2
Catalog Number:
AG01BCLF
Molecular Formula:
C10H9F3O2
Molecular Weight:
218.1725
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Product Description
Catalog Number:
AG01BCLF
Chemical Name:
1-[2-hydroxy-4-(trifluoromethyl)phenyl]propan-1-one
CAS Number:
1261680-31-2
Molecular Formula:
C10H9F3O2
Molecular Weight:
218.1725
MDL Number:
MFCD18397727
IUPAC Name:
1-[2-hydroxy-4-(trifluoromethyl)phenyl]propan-1-one
InChI:
InChI=1S/C10H9F3O2/c1-2-8(14)7-4-3-6(5-9(7)15)10(11,12)13/h3-5,15H,2H2,1H3
InChI Key:
IIFNJVYRGAIWER-UHFFFAOYSA-N
SMILES:
CCC(=O)c1ccc(cc1O)C(F)(F)F
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.055g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.175g/mol
Monoisotopic Mass:
218.055g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties