Propanedioic acid, (acetylamino)-, diethyl ester


Chemical Name: Propanedioic acid, (acetylamino)-, diethyl ester
CAS Number: 1068-90-2
Product Number: AG003PG2(AGN-PC-0JKBIR)
Synonyms:
MDL No:
Molecular Formula: C9H15NO5
Molecular Weight: 217.2191

Identification/Properties


Properties
MP:
93 - 96 C
BP:
311.4 C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Refractive Index:
1.4640 (estimate)
Computed Properties
Molecular Weight:
217.221g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
7
Exact Mass:
217.095g/mol
Monoisotopic Mass:
217.095g/mol
Topological Polar Surface Area:
81.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
233
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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:
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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