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2101206-39-5 | tert-butyl 3,3-difluoro-4-(4-nitrophenoxy)piperidine-1-carboxylate
CAS No: 2101206-39-5 Catalog No: AG01FP5A MDL No:
Product Description
Catalog Number:
AG01FP5A
Chemical Name:
tert-butyl 3,3-difluoro-4-(4-nitrophenoxy)piperidine-1-carboxylate
CAS Number:
2101206-39-5
IUPAC Name:
tert-butyl 3,3-difluoro-4-(4-nitrophenoxy)piperidine-1-carboxylate
InChI:
InChI=1S/C16H20F2N2O5/c1-15(2,3)25-14(21)19-9-8-13(16(17,18)10-19)24-12-6-4-11(5-7-12)20(22)23/h4-7,13H,8-10H2,1-3H3
InChI Key:
MTMVXQYPKBHJBW-UHFFFAOYSA-N
Properties
Complexity:
496
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.134g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
358.342g/mol
Monoisotopic Mass:
358.134g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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