Home Other Building Blocks 2,2,2-Trifluoroethyl butyrate

2,2,2-Trifluoroethyl butyrate

CAS No.:
371-27-7
Catalog Number:
AG003F76
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(GC)
1 week
United States
$142
- +
Product Description
Catalog Number:
AG003F76
Chemical Name:
2,2,2-Trifluoroethyl butyrate
CAS Number:
371-27-7
MDL Number:
MFCD00077609
IUPAC Name:
2,2,2-trifluoroethyl butanoate
InChI:
InChI=1S/C6H9F3O2/c1-2-3-5(10)11-4-6(7,8)9/h2-4H2,1H3
InChI Key:
DEXWRCYOMLUJRF-UHFFFAOYSA-N
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.055g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.131g/mol
Monoisotopic Mass:
170.055g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Insect pest control agents: Novel chiral butanoate esters (juvenogens). Bioorganic & medicinal chemistry 20070915
(S)-selective dynamic kinetic resolution of secondary alcohols by the combination of subtilisin and an aminocyclopentadienylruthenium complex as the catalysts. Journal of the American Chemical Society 20030924
Properties