Home Sulfos tert-butyl 2-{[1-(ethanesulfonyl)piperidin-4-yl]amino}acetate

tert-butyl 2-{[1-(ethanesulfonyl)piperidin-4-yl]amino}acetate

CAS No.:
1795433-82-7
Catalog Number:
AG01AUYY
Molecular Formula:
C13H26N2O4S
Molecular Weight:
306.4215
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Product Description
Catalog Number:
AG01AUYY
Chemical Name:
tert-butyl 2-{[1-(ethanesulfonyl)piperidin-4-yl]amino}acetate
CAS Number:
1795433-82-7
Molecular Formula:
C13H26N2O4S
Molecular Weight:
306.4215
MDL Number:
MFCD28064204
IUPAC Name:
tert-butyl 2-[(1-ethylsulfonylpiperidin-4-yl)amino]acetate
InChI:
InChI=1S/C13H26N2O4S/c1-5-20(17,18)15-8-6-11(7-9-15)14-10-12(16)19-13(2,3)4/h11,14H,5-10H2,1-4H3
InChI Key:
NDKUZFNQRXBRHA-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)N1CCC(CC1)NCC(=O)OC(C)(C)C
Properties
Complexity:
415  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.161g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
306.421g/mol
Monoisotopic Mass:
306.161g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties