Home Other Building Blocks tert-butyl 2,2,2-trifluoroethyl oxalate

tert-butyl 2,2,2-trifluoroethyl oxalate

CAS No.:
1803582-93-5
Catalog Number:
AG01AG5V
Molecular Formula:
C8H11F3O4
Molecular Weight:
228.1657
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Product Description
Catalog Number:
AG01AG5V
Chemical Name:
tert-butyl 2,2,2-trifluoroethyl oxalate
CAS Number:
1803582-93-5
Molecular Formula:
C8H11F3O4
Molecular Weight:
228.1657
MDL Number:
MFCD28023691
IUPAC Name:
2-O-tert-butyl 1-O-(2,2,2-trifluoroethyl) oxalate
InChI:
InChI=1S/C8H11F3O4/c1-7(2,3)15-6(13)5(12)14-4-8(9,10)11/h4H2,1-3H3
InChI Key:
VAYBILISVGIYDM-UHFFFAOYSA-N
SMILES:
O=C(C(=O)OCC(F)(F)F)OC(C)(C)C
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.061g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.167g/mol
Monoisotopic Mass:
228.061g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties