Propanoic acid, 3-iodo-, ethyl ester


Chemical Name: Propanoic acid, 3-iodo-, ethyl ester
CAS Number: 6414-69-3
Product Number: AG003Q7Y(AGN-PC-0NCOMH)
Synonyms:
MDL No:
Molecular Formula: C5H9IO2
Molecular Weight: 228.0282

Identification/Properties


Properties
BP:
203°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
1.4961
Computed Properties
Molecular Weight:
228.029g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
227.965g/mol
Monoisotopic Mass:
227.965g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
72.8
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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