Home Other Building Blocks 1-[2-hydroxy-3-(trifluoromethyl)phenyl]ethan-1-one

1-[2-hydroxy-3-(trifluoromethyl)phenyl]ethan-1-one

CAS No.:
1144501-67-6
Catalog Number:
AG01BHLE
Molecular Formula:
C9H7F3O2
Molecular Weight:
204.1459
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Product Description
Catalog Number:
AG01BHLE
Chemical Name:
1-[2-hydroxy-3-(trifluoromethyl)phenyl]ethan-1-one
CAS Number:
1144501-67-6
Molecular Formula:
C9H7F3O2
Molecular Weight:
204.1459
MDL Number:
MFCD18397605
IUPAC Name:
1-[2-hydroxy-3-(trifluoromethyl)phenyl]ethanone
InChI:
InChI=1S/C9H7F3O2/c1-5(13)6-3-2-4-7(8(6)14)9(10,11)12/h2-4,14H,1H3
InChI Key:
AFTZVZKIPQCZPT-UHFFFAOYSA-N
SMILES:
CC(=O)c1cccc(c1O)C(F)(F)F
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.148g/mol
Monoisotopic Mass:
204.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties