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Home Carboxys tert-Butyl 3-(4-nitrophenoxy)tetrahydro-1(2h)-pyridinecarboxylate

tert-Butyl 3-(4-nitrophenoxy)tetrahydro-1(2h)-pyridinecarboxylate

CAS No.:
690632-16-7
Catalog Number:
AG005YJG
Molecular Formula:
C16H22N2O5
Molecular Weight:
322.3563
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$205
- +
1g
95%
1 week
United States
$510
- +
Product Description
Catalog Number:
AG005YJG
Chemical Name:
tert-Butyl 3-(4-nitrophenoxy)tetrahydro-1(2h)-pyridinecarboxylate
CAS Number:
690632-16-7
Molecular Formula:
C16H22N2O5
Molecular Weight:
322.3563
MDL Number:
MFCD05865146
IUPAC Name:
tert-butyl 3-(4-nitrophenoxy)piperidine-1-carboxylate
InChI:
InChI=1S/C16H22N2O5/c1-16(2,3)23-15(19)17-10-4-5-14(11-17)22-13-8-6-12(7-9-13)18(20)21/h6-9,14H,4-5,10-11H2,1-3H3
InChI Key:
XPOFZYJUWZHERT-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC(C1)Oc1ccc(cc1)[N+](=O)[O-])OC(C)(C)C
Properties
Complexity:
421  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.153g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.361g/mol
Monoisotopic Mass:
322.153g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties