50437-61-1
Product Name:
METHYL 4-[(4-METHYLPHENYL)SULFANYL]-3-NITROBENZENECARBOXYLATE
Formula:
C15H13NO4S
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COMPUTED DESCRIPTORS
Molecular Weight | 303.3 g/mol |
---|---|
XLogP3 | 4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 303.05652907 g/mol |
Monoisotopic Mass | 303.05652907 g/mol |
Topological Polar Surface Area | 97.4 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 376 |
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 |