88796-28-5
Product Name:
5-AMINO-3-METHYL-2-THIOPHENECARBOXYLIC ACID ETHYL ESTER
Formula:
C8H11NO2S
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COMPUTED DESCRIPTORS
Molecular Weight | 185.25 g/mol |
---|---|
XLogP3 | 2.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
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 | 174 |
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 |