Home Other Building Blocks 2,2,2-Trifluoro-3'-(trifluoromethyl)acetophenone

2,2,2-Trifluoro-3'-(trifluoromethyl)acetophenone

CAS No.:
721-37-9
Catalog Number:
AG0032W6
Molecular Formula:
C9H4F6O
Molecular Weight:
242.1179
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$132
- +
5g
95%
In Stock USA
United States
$263
- +
25g
95%
In Stock USA
United States
$813
- +
Product Description
Catalog Number:
AG0032W6
Chemical Name:
2,2,2-Trifluoro-3'-(trifluoromethyl)acetophenone
CAS Number:
721-37-9
Molecular Formula:
C9H4F6O
Molecular Weight:
242.1179
MDL Number:
MFCD00061275
IUPAC Name:
2,2,2-trifluoro-1-[3-(trifluoromethyl)phenyl]ethanone
InChI:
InChI=1S/C9H4F6O/c10-8(11,12)6-3-1-2-5(4-6)7(16)9(13,14)15/h1-4H
InChI Key:
MDCHHRZBYSSONX-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)c1cccc(c1)C(F)(F)F
NSC Number:
55520
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.017g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.12g/mol
Monoisotopic Mass:
242.017g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties