Propanoic acid, 3-isocyanato-, ethyl ester


Chemical Name: Propanoic acid, 3-isocyanato-, ethyl ester
CAS Number: 5100-34-5
Product Number: AG003Q7Z(AGN-PC-0KK60N)
Synonyms:
MDL No:
Molecular Formula: C6H9NO3
Molecular Weight: 143.1406

Identification/Properties


Properties
BP:
191.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
143.142g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
143.058g/mol
Monoisotopic Mass:
143.058g/mol
Topological Polar Surface Area:
55.7A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
149
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


NMR Spectrum


Other Analytical Data


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