200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 122902-06-1
122902-06-1 | Cyclohexanone, 3-[4-(trifluoromethyl)phenyl]-
CAS No: 122902-06-1 Catalog No: AG000JR6 MDL No:
Product Description
Catalog Number:
AG000JR6
Chemical Name:
Cyclohexanone, 3-[4-(trifluoromethyl)phenyl]-
CAS Number:
122902-06-1
Molecular Formula:
C13H13F3O
Molecular Weight:
242.2369
IUPAC Name:
3-[4-(trifluoromethyl)phenyl]cyclohexan-1-one
InChI:
InChI=1S/C13H13F3O/c14-13(15,16)11-6-4-9(5-7-11)10-2-1-3-12(17)8-10/h4-7,10H,1-3,8H2
InChI Key:
PXEDGGLZDRNQLK-UHFFFAOYSA-N
SMILES:
O=C1CCCC(C1)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
277
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.