Propanenitrile, 2-methoxy-, (S)-


Chemical Name: Propanenitrile, 2-methoxy-, (S)-
CAS Number: 64531-49-3
Product Number: AG00EELA(AGN-PC-0OESI2)
Synonyms:
MDL No:
Molecular Formula: C4H7NO
Molecular Weight: 85.1045

Identification/Properties


Properties
BP:
113°C
Storage:
2-8℃;
Computed Properties
Molecular Weight:
85.106g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
85.053g/mol
Monoisotopic Mass:
85.053g/mol
Topological Polar Surface Area:
33A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
70.9
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



Propanenitrile, 2-methoxy-, (S)- (9CI) is a valuable compound widely utilized in chemical synthesis for the preparation of various organic compounds. Its unique properties make it a versatile building block in the development of pharmaceuticals, agrochemicals, and specialty chemicals. This compound serves as a key intermediate in the synthesis of complex organic molecules due to its reactivity and ability to participate in a variety of chemical reactions. Its applications range from the production of fine chemicals to the creation of novel materials with tailored properties. In chemical synthesis, Propanenitrile, 2-methoxy-, (S)- (9CI) plays a crucial role in the design and development of innovative compounds with diverse applications in research and industry.