Home Carboxys benzyl 3-oxo-4-(2,2,2-trifluoroethyl)piperazine-1-carboxylate

benzyl 3-oxo-4-(2,2,2-trifluoroethyl)piperazine-1-carboxylate

CAS No.:
1461705-24-7
Catalog Number:
AG01A71V
Molecular Formula:
C14H15F3N2O3
Molecular Weight:
316.2757
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A71V
Chemical Name:
benzyl 3-oxo-4-(2,2,2-trifluoroethyl)piperazine-1-carboxylate
CAS Number:
1461705-24-7
Molecular Formula:
C14H15F3N2O3
Molecular Weight:
316.2757
MDL Number:
MFCD25970510
IUPAC Name:
benzyl 3-oxo-4-(2,2,2-trifluoroethyl)piperazine-1-carboxylate
InChI:
InChI=1S/C14H15F3N2O3/c15-14(16,17)10-19-7-6-18(8-12(19)20)13(21)22-9-11-4-2-1-3-5-11/h1-5H,6-10H2
InChI Key:
JFSXECVVLRLPNQ-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(C(=O)C1)CC(F)(F)F)OCc1ccccc1
Properties
Complexity:
409  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.103g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
316.28g/mol
Monoisotopic Mass:
316.103g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties