Propanoic acid, 2-nitro-, ethyl ester


Chemical Name: Propanoic acid, 2-nitro-, ethyl ester
CAS Number: 2531-80-8
Product Number: AG003Q53(AGN-PC-0JM2SR)
Synonyms:
MDL No:
Molecular Formula: C5H9NO4
Molecular Weight: 147.1293

Identification/Properties


Properties
BP:
75-76 °C9 mm Hg(lit.)
Storage:
Room Temperature;Keep in dry area;
Refractive Index:
n20/D 1.421(lit.)
Computed Properties
Molecular Weight:
147.13g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
147.053g/mol
Monoisotopic Mass:
147.053g/mol
Topological Polar Surface Area:
72.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
139
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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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