Cyclopropanecarboxylic acid, 1-cyano-, ethyl ester


Chemical Name: Cyclopropanecarboxylic acid, 1-cyano-, ethyl ester
CAS Number: 1558-81-2
Product Number: AG001O8I(AGN-PC-0JPWYP)
Synonyms:
MDL No:
Molecular Formula: C7H9NO2
Molecular Weight: 139.1519

Identification/Properties


Computed Properties
Molecular Weight:
139.154g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
139.063g/mol
Monoisotopic Mass:
139.063g/mol
Topological Polar Surface Area:
50.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
197
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

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NMR Spectrum


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