Home Other Building Blocks 4-[3-(trifluoromethyl)phenyl]cyclohexan-1-one

4-[3-(trifluoromethyl)phenyl]cyclohexan-1-one

CAS No.:
40503-93-3
Catalog Number:
AG01BE7L
Molecular Formula:
C13H13F3O
Molecular Weight:
242.2369
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BE7L
Chemical Name:
4-[3-(trifluoromethyl)phenyl]cyclohexan-1-one
CAS Number:
40503-93-3
Molecular Formula:
C13H13F3O
Molecular Weight:
242.2369
MDL Number:
MFCD25323932
IUPAC Name:
4-[3-(trifluoromethyl)phenyl]cyclohexan-1-one
InChI:
InChI=1S/C13H13F3O/c14-13(15,16)11-3-1-2-10(8-11)9-4-6-12(17)7-5-9/h1-3,8-9H,4-7H2
InChI Key:
XAOCHZUKYOVYOQ-UHFFFAOYSA-N
SMILES:
O=C1CCC(CC1)c1cccc(c1)C(F)(F)F
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.092g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.241g/mol
Monoisotopic Mass:
242.092g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties