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172843-96-8

172843-96-8 structural image
Product Name: METHYL(2S)-2-AMINO-3-(THIOPHEN-3-YL)PROPANOATE
Formula: C8H11NO2S
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COMPUTED DESCRIPTORS

Molecular Weight 185.25 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 185.05104977 g/mol
Monoisotopic Mass 185.05104977 g/mol
Topological Polar Surface Area 80.6 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 163
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