Cyclobutanecarboxylic acid, 1-cyano-, ethyl ester


Chemical Name: Cyclobutanecarboxylic acid, 1-cyano-, ethyl ester
CAS Number: 28246-87-9
Product Number: AG007L19(AGN-PC-0JP1PA)
Synonyms:
MDL No:
Molecular Formula: C8H11NO2
Molecular Weight: 153.1784

Identification/Properties


Computed Properties
Molecular Weight:
153.181g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
153.079g/mol
Monoisotopic Mass:
153.079g/mol
Topological Polar Surface Area:
50.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
209
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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