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Product Name:
2-NITRO-4-(TRIFLUOROMETHYL)PHENYLTHIOGLYCOLIC ACID
Formula:
C9H6F3NO4S
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COMPUTED DESCRIPTORS
Molecular Weight | 281.21 g/mol |
---|---|
XLogP3 | 2.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 3 |
Exact Mass | 280.99696333 g/mol |
Monoisotopic Mass | 280.99696333 g/mol |
Topological Polar Surface Area | 108 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 331 |
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 |