Home Other Building Blocks Methyl 3,3,3-trifluoropropionate

Methyl 3,3,3-trifluoropropionate

CAS No.:
18830-44-9
Catalog Number:
AG002GTL
Molecular Formula:
C4H5F3O2
Molecular Weight:
142.0765
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(GC)
1 week
United States
$169
- +
5g
>98.0%(GC)
1 week
United States
$392
- +
Product Description
Catalog Number:
AG002GTL
Chemical Name:
Methyl 3,3,3-trifluoropropionate
CAS Number:
18830-44-9
Molecular Formula:
C4H5F3O2
Molecular Weight:
142.0765
MDL Number:
MFCD02262206
IUPAC Name:
methyl 3,3,3-trifluoropropanoate
InChI:
InChI=1S/C4H5F3O2/c1-9-3(8)2-4(5,6)7/h2H2,1H3
InChI Key:
PMGBATZKLCISOD-UHFFFAOYSA-N
SMILES:
COC(=O)CC(F)(F)F
Properties
Complexity:
107  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.024g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.077g/mol
Monoisotopic Mass:
142.024g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties