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67171-55-5

67171-55-5 structural image
Product Name: METHYL 2-AMINO-4-PHENYLTHIOPHENE-3-CARBOXYLATE
Formula: C12H11NO2S
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COMPUTED DESCRIPTORS

Molecular Weight 233.29 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 233.05104977 g/mol
Monoisotopic Mass 233.05104977 g/mol
Topological Polar Surface Area 80.6 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 253
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