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

2-[4-(trifluoromethyl)phenyl]cyclopentan-1-one

CAS No.:
1253111-75-9
Catalog Number:
AG01A4UY
Molecular Formula:
C12H11F3O
Molecular Weight:
228.2103
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Product Description
Catalog Number:
AG01A4UY
Chemical Name:
2-[4-(trifluoromethyl)phenyl]cyclopentan-1-one
CAS Number:
1253111-75-9
Molecular Formula:
C12H11F3O
Molecular Weight:
228.2103
MDL Number:
MFCD16659594
IUPAC Name:
2-[4-(trifluoromethyl)phenyl]cyclopentan-1-one
InChI:
InChI=1S/C12H11F3O/c13-12(14,15)9-6-4-8(5-7-9)10-2-1-3-11(10)16/h4-7,10H,1-3H2
InChI Key:
YMZZBSKQIAYNGR-UHFFFAOYSA-N
SMILES:
O=C1CCCC1c1ccc(cc1)C(F)(F)F
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.076g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.214g/mol
Monoisotopic Mass:
228.076g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties