Home Carboxys tert-Butyl 4-(2-Acetoxy-1,1-difluoroethyl)piperidine-1-carboxylate

tert-Butyl 4-(2-Acetoxy-1,1-difluoroethyl)piperidine-1-carboxylate

CAS No.:
1864073-07-3
Catalog Number:
AG01D8R6
Molecular Formula:
C14H23F2NO4
Molecular Weight:
307.3335
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Product Description
Catalog Number:
AG01D8R6
Chemical Name:
tert-Butyl 4-(2-Acetoxy-1,1-difluoroethyl)piperidine-1-carboxylate
CAS Number:
1864073-07-3
Molecular Formula:
C14H23F2NO4
Molecular Weight:
307.3335
MDL Number:
MFCD28155101
IUPAC Name:
tert-butyl 4-(2-acetyloxy-1,1-difluoroethyl)piperidine-1-carboxylate
InChI:
InChI=1S/C14H23F2NO4/c1-10(18)20-9-14(15,16)11-5-7-17(8-6-11)12(19)21-13(2,3)4/h11H,5-9H2,1-4H3
InChI Key:
HDEJCXYZHVBZTB-UHFFFAOYSA-N
SMILES:
CC(=O)OCC(C1CCN(CC1)C(=O)OC(C)(C)C)(F)F
Properties
Complexity:
385  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.16g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.338g/mol
Monoisotopic Mass:
307.16g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties