4-Pentenoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, (2S)-


Chemical Name: 4-Pentenoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, (2S)-
CAS Number: 90600-20-7
Product Number: AG003R8J(AGN-PC-0OMEB7)
Synonyms:
MDL No:
Molecular Formula: C10H17NO4
Molecular Weight: 215.2463

Identification/Properties


Properties
BP:
334.3°C at 760 mmHg
Storage:
2-8℃;
Form:
Liquid
Refractive Index:
1.4610 (estimate)
Computed Properties
Molecular Weight:
215.249g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
215.116g/mol
Monoisotopic Mass:
215.116g/mol
Topological Polar Surface Area:
75.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
255
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#:
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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