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Home Other Building Blocks 3',5'-bis(trifluoromethyl)acetophenone

3',5'-bis(trifluoromethyl)acetophenone

CAS No.:
30071-93-3
Catalog Number:
AG0033IZ
Molecular Formula:
C10H6F6O
Molecular Weight:
256.1445
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$32
- +
100g
98%
In Stock USA
United States
$69
- +
500g
98%
In Stock USA
United States
$275
- +
Product Description
Catalog Number:
AG0033IZ
Chemical Name:
3',5'-bis(trifluoromethyl)acetophenone
CAS Number:
30071-93-3
Molecular Formula:
C10H6F6O
Molecular Weight:
256.1445
MDL Number:
MFCD00009910
IUPAC Name:
1-[3,5-bis(trifluoromethyl)phenyl]ethanone
InChI:
InChI=1S/C10H6F6O/c1-5(17)6-2-7(9(11,12)13)4-8(3-6)10(14,15)16/h2-4H,1H3
InChI Key:
MCYCSIKSZLARBD-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
EC Number:
250-023-7
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.032g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.147g/mol
Monoisotopic Mass:
256.032g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Literature
Title Journal
[Medium optimization for enhanced production of carbonyl reductase by Candida tropicalis 104 by response surface methodology]. Sheng wu gong cheng xue bao = Chinese journal of biotechnology 20090601
An improved preparation of 3,5-bis(trifluoromethyl)acetophenone and safety considerations in the preparation of 3,5-bis(trifluoromethyl)phenyl Grignard reagent. The Journal of organic chemistry 20030502
Properties