Home Carboxys rac-tert-butyl (3R,4S)-3-amino-4-(4-ethoxyphenyl)piperidine-1-carboxylate, cis

rac-tert-butyl (3R,4S)-3-amino-4-(4-ethoxyphenyl)piperidine-1-carboxylate, cis

CAS No.:
1969288-28-5
Catalog Number:
AG01B5OY
Molecular Formula:
C18H28N2O3
Molecular Weight:
320.4265
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Product Description
Catalog Number:
AG01B5OY
Chemical Name:
rac-tert-butyl (3R,4S)-3-amino-4-(4-ethoxyphenyl)piperidine-1-carboxylate, cis
CAS Number:
1969288-28-5
Molecular Formula:
C18H28N2O3
Molecular Weight:
320.4265
MDL Number:
MFCD30181831
IUPAC Name:
tert-butyl (3R,4S)-3-amino-4-(4-ethoxyphenyl)piperidine-1-carboxylate
InChI:
InChI=1S/C18H28N2O3/c1-5-22-14-8-6-13(7-9-14)15-10-11-20(12-16(15)19)17(21)23-18(2,3)4/h6-9,15-16H,5,10-12,19H2,1-4H3/t15-,16-/m0/s1
InChI Key:
XNWGFNYVKSTZCX-HOTGVXAUSA-N
SMILES:
CCOc1ccc(cc1)[C@@H]1CCN(C[C@@H]1N)C(=O)OC(C)(C)C
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
320.21g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
320.433g/mol
Monoisotopic Mass:
320.21g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
64.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties