Home Carbonyls ethyl 2-{[(tert-butoxy)carbonyl]amino}-3-hydroxy-3-(pyridin-2-yl)propanoate

ethyl 2-{[(tert-butoxy)carbonyl]amino}-3-hydroxy-3-(pyridin-2-yl)propanoate

CAS No.:
2044712-92-5
Catalog Number:
AG01BXLZ
Molecular Formula:
C15H22N2O5
Molecular Weight:
310.3456
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Product Description
Catalog Number:
AG01BXLZ
Chemical Name:
ethyl 2-{[(tert-butoxy)carbonyl]amino}-3-hydroxy-3-(pyridin-2-yl)propanoate
CAS Number:
2044712-92-5
Molecular Formula:
C15H22N2O5
Molecular Weight:
310.3456
MDL Number:
MFCD30487868
IUPAC Name:
ethyl 3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-pyridin-2-ylpropanoate
InChI:
InChI=1S/C15H22N2O5/c1-5-21-13(19)11(17-14(20)22-15(2,3)4)12(18)10-8-6-7-9-16-10/h6-9,11-12,18H,5H2,1-4H3,(H,17,20)
InChI Key:
WLEJPYXRAKIOGF-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(c1ccccn1)O)NC(=O)OC(C)(C)C
Properties
Complexity:
381  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.153g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
310.35g/mol
Monoisotopic Mass:
310.153g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
97.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties