Home Other Building Blocks Ethyl 2-ethyl-4,4,4-trifluoro-3-oxobutanoate

Ethyl 2-ethyl-4,4,4-trifluoro-3-oxobutanoate

CAS No.:
3854-50-0
Catalog Number:
AG00C7XH
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$180
- +
1g
1 week
United States
$320
- +
Product Description
Catalog Number:
AG00C7XH
Chemical Name:
Ethyl 2-ethyl-4,4,4-trifluoro-3-oxobutanoate
CAS Number:
3854-50-0
MDL Number:
MFCD05864378
IUPAC Name:
ethyl 2-ethyl-4,4,4-trifluoro-3-oxobutanoate
InChI:
InChI=1S/C8H11F3O3/c1-3-5(7(13)14-4-2)6(12)8(9,10)11/h5H,3-4H2,1-2H3
InChI Key:
RRFFKINDACKLJY-UHFFFAOYSA-N
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.066g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.168g/mol
Monoisotopic Mass:
212.066g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Ethyl 6-(4-fluoro-phen-yl)-4-hy-droxy-2-oxo-4-trifluoro-meth-yl-1,3-diazinane-5-carboxyl-ate monohydrate. Acta crystallographica. Section E, Structure reports online 20110701
Properties