Home Other Building Blocks Ethyl 4,4,4-Trifluoro-2-methyl-3-oxobutyrate

Ethyl 4,4,4-Trifluoro-2-methyl-3-oxobutyrate

CAS No.:
344-00-3
Catalog Number:
AG0034UK
Molecular Formula:
C7H9F3O3
Molecular Weight:
198.1398
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96% GC
1 week
United States
$17
- +
Product Description
Catalog Number:
AG0034UK
Chemical Name:
Ethyl 4,4,4-Trifluoro-2-methyl-3-oxobutyrate
CAS Number:
344-00-3
Molecular Formula:
C7H9F3O3
Molecular Weight:
198.1398
MDL Number:
MFCD00190635
IUPAC Name:
ethyl 4,4,4-trifluoro-2-methyl-3-oxobutanoate
InChI:
InChI=1S/C7H9F3O3/c1-3-13-6(12)4(2)5(11)7(8,9)10/h4H,3H2,1-2H3
InChI Key:
YLRGPBKEZVHOAW-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(=O)C(F)(F)F)C
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.05g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.141g/mol
Monoisotopic Mass:
198.05g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties