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869792-40-5

869792-40-5 structural image
Product Name: 2-Pentenoic acid, 3-amino-4,4-dimethyl-, methyl ester, (2Z)-
Formula: C8H15NO2
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COMPUTED DESCRIPTORS

Molecular Weight 157.21 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 157.110278721 g/mol
Monoisotopic Mass 157.110278721 g/mol
Topological Polar Surface Area 52.3 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 177
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes