112043-90-0
Product Name:
1,3-BENZENE(DICARBOXYLIC ACID-13C2)
Formula:
C8H6O4
Synonyms:
1,3-Benzene(dicarboxylic acid-13C2)
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COMPUTED DESCRIPTORS
| Molecular Weight | 168.12 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 168.03331834 g/mol |
| Monoisotopic Mass | 168.03331834 g/mol |
| Topological Polar Surface Area | 74.6 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 179 |
| Isotope Atom Count | 2 |
| 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 |