2-Furanpropanoic acid, β-[[(1,1-dimethylethoxy)carbonyl]amino]-, (βS)-


Chemical Name: 2-Furanpropanoic acid, β-[[(1,1-dimethylethoxy)carbonyl]amino]-, (βS)-
CAS Number: 1217736-81-6
Product Number: AG0015XM(AGN-PC-0WBO74)
Synonyms:
MDL No:
Molecular Formula: C12H17NO5
Molecular Weight: 255.2671

Identification/Properties


Computed Properties
Molecular Weight:
255.27g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
255.111g/mol
Monoisotopic Mass:
255.111g/mol
Topological Polar Surface Area:
88.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
310
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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