Propanedioic acid, (aminomethylene)-, diethyl ester


Chemical Name: Propanedioic acid, (aminomethylene)-, diethyl ester
CAS Number: 6296-99-7
Product Number: AG00EBHL(AGN-PC-0JO6CE)
Synonyms:
MDL No:
Molecular Formula: C8H13NO4
Molecular Weight: 187.1931

Identification/Properties


Properties
MP:
56-59 °C
BP:
263.4°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
187.195g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
187.084g/mol
Monoisotopic Mass:
187.084g/mol
Topological Polar Surface Area:
78.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
202
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:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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