Home Other Building Blocks 1-[3-(Trifluoromethyl)phenyl]pent-4-en-1-one

1-[3-(Trifluoromethyl)phenyl]pent-4-en-1-one

CAS No.:
125996-99-8
Catalog Number:
AG000QNH
Molecular Formula:
C12H11F3O
Molecular Weight:
228.2103
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$100
- +
5g
96%
In Stock USA
United States
$300
- +
10g
96%
In Stock USA
United States
$525
- +
25g
96%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG000QNH
Chemical Name:
1-[3-(Trifluoromethyl)phenyl]pent-4-en-1-one
CAS Number:
125996-99-8
Molecular Formula:
C12H11F3O
Molecular Weight:
228.2103
MDL Number:
MFCD20290692
IUPAC Name:
1-[3-(trifluoromethyl)phenyl]pent-4-en-1-one
InChI:
InChI=1S/C12H11F3O/c1-2-3-7-11(16)9-5-4-6-10(8-9)12(13,14)15/h2,4-6,8H,1,3,7H2
InChI Key:
UCVAOVDXZWAFPR-UHFFFAOYSA-N
SMILES:
C=CCCC(=O)c1cccc(c1)C(F)(F)F
Properties
Complexity:
258  
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:
4  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties