500292-86-4
Product Name:
(2E)-3-(4-amino-3,5-dimethylphenyl)prop-2-enenitrile
Formula:
C11H12N2
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COMPUTED DESCRIPTORS
| Molecular Weight | 172.23 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 172.100048391 g/mol |
| Monoisotopic Mass | 172.100048391 g/mol |
| Topological Polar Surface Area | 49.8 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 224 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |