Oxiranecarboxylic acid,3-[[[(1S)-3-methyl-1-[[(3-methylbutyl)amino]carbonyl]butyl]amino]carbonyl]-, ethyl ester, (2S,3S)-


Chemical Name: Oxiranecarboxylic acid,3-[[[(1S)-3-methyl-1-[[(3-methylbutyl)amino]carbonyl]butyl]amino]carbonyl]-, ethyl ester, (2S,3S)-
CAS Number: 88321-09-9
Product Number: AG0048C1(AGN-PC-0VKP19)
Synonyms:
MDL No: MFCD00132883
Molecular Formula: C17H30N2O5
Molecular Weight: 342.4305

Identification/Properties


Properties
MP:
126.2°C
BP:
477.88°C (rough estimate)
Storage:
Keep in dry area;-10 ℃;
Form:
Solid
Refractive Index:
1.5800 (estimate)
Solubility:
Soluble in DMSO, DMF or ethanol
Computed Properties
Molecular Weight:
342.436g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
11
Exact Mass:
342.215g/mol
Monoisotopic Mass:
342.215g/mol
Topological Polar Surface Area:
97A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
450
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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