1,3-Dioxane-4-acetic acid, 6-(2-aminoethyl)-2,2-dimethyl-,1,1-dimethylethyl ester, (4R,6R)-


Chemical Name: 1,3-Dioxane-4-acetic acid, 6-(2-aminoethyl)-2,2-dimethyl-,1,1-dimethylethyl ester, (4R,6R)-
CAS Number: 125995-13-3
Product Number: AG000QNK(AGN-PC-0PI68L)
Synonyms:
MDL No: MFCD07369252
Molecular Formula: C14H27NO4
Molecular Weight: 273.3685

Identification/Properties


Properties
BP:
339.8°C at 760 mmHg
Storage:
Light sensitive;2-8℃;
Form:
Liquid
Refractive Index:
1.454-1.456
Computed Properties
Molecular Weight:
273.373g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
273.194g/mol
Monoisotopic Mass:
273.194g/mol
Topological Polar Surface Area:
70.8A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
309
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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