2007916-48-3
Product Name:
1H-Azepine-3-carboxylic acid, hexahydro-, hydrochloride (1:1)
Formula:
C7H14ClNO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 179.64 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 179.0713064 g/mol |
| Monoisotopic Mass | 179.0713064 g/mol |
| Topological Polar Surface Area | 49.3 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 125 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |