Home Carbonyls 2H-Pyran-4-propanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]tetrahydro-

2H-Pyran-4-propanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]tetrahydro-

CAS No.:
182287-51-0
Catalog Number:
AG0023KM
Molecular Formula:
C13H23NO5
Molecular Weight:
273.3254
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Product Description
Catalog Number:
AG0023KM
Chemical Name:
2H-Pyran-4-propanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]tetrahydro-
CAS Number:
182287-51-0
Molecular Formula:
C13H23NO5
Molecular Weight:
273.3254
MDL Number:
MFCD02683139
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(oxan-4-yl)propanoic acid
InChI:
InChI=1S/C13H23NO5/c1-13(2,3)19-12(17)14-10(11(15)16)8-9-4-6-18-7-5-9/h9-10H,4-8H2,1-3H3,(H,14,17)(H,15,16)
InChI Key:
NKYZORHKIYSSEL-UHFFFAOYSA-N
SMILES:
OC(=O)C(NC(=O)OC(C)(C)C)CC1CCOCC1
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.158g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
273.329g/mol
Monoisotopic Mass:
273.158g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties