412936-84-6
Product Name:
3-(3,4-DIMETHYL-BENZENESULFONYL)-PROPIONIC ACID
Formula:
C11H14O4S
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COMPUTED DESCRIPTORS
Molecular Weight | 242.29 g/mol |
---|---|
XLogP3 | 1.4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 4 |
Exact Mass | 242.06128010 g/mol |
Monoisotopic Mass | 242.06128010 g/mol |
Topological Polar Surface Area | 79.8 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 342 |
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 |