tert-butyl 4-[[3-(trifluoromethyl)phenoxy]methyl]piperidine-1-carboxylate


Chemical Name: tert-butyl 4-[[3-(trifluoromethyl)phenoxy]methyl]piperidine-1-carboxylate
CAS Number: 954229-23-3
Product Number: AG00IJ2D(AGN-PC-04TLB5)
Synonyms:
MDL No:
Molecular Formula: C18H24F3NO3
Molecular Weight: 359.3833

Identification/Properties


Computed Properties
Molecular Weight:
359.389g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
5
Exact Mass:
359.171g/mol
Monoisotopic Mass:
359.171g/mol
Topological Polar Surface Area:
38.8A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
440
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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