- Min.Order :1 Kilogram
- Purity: 98%
- Payment Terms : T/T,
Keywords
313648-62-3 4-(1-adamantyl)-2,6-dinitrophenol 4-(Adamantan-1-yl)-2,6-dinitrophenol
Quick Details
- Appearance:yellow crystal
- Application:313648-62-3
- PackAge:1kg.5kg,10kg,25kg
- ProductionCapacity:2|Metric Ton|Month
- Storage:AMB
- Transportation:313648-62-3
Superiority:
| Molecular Weight | 318.32452 [g/mol] | |
| Molecular Formula | C16H18N2O5 | |
| XLogP3-AA | 5.2 | |
| H-Bond Donor | 1 | |
| H-Bond Acceptor | 5 | |
| Rotatable Bond Count | 1 | |
| Tautomer Count | 3 | |
| Exact Mass | 318.121572 | |
| MonoIsotopic Mass | 318.121572 | |
| Topological Polar Surface Area | 112 | |
| Heavy Atom Count | 23 | |
| Formal Charge | 0 | |
| Complexity | 460 | |
| 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 | |
| Feature 3D Acceptor Count | 4 | |
| Feature 3D Donor Count | 1 | |
| Feature 3D Anion Count | 2 | |
| Feature 3D Ring Count | 5 | |
| Effective Rotor Count | 4.2 | |
| Conformer Sampling RMSD | 0.8 | |
| CID Conformer Count | 1 |
Details:
| Molecular Weight | 318.32452 [g/mol] | |
| Molecular Formula | C16H18N2O5 | |
| XLogP3-AA | 5.2 | |
| H-Bond Donor | 1 | |
| H-Bond Acceptor | 5 | |
| Rotatable Bond Count | 1 | |
| Tautomer Count | 3 | |
| Exact Mass | 318.121572 | |
| MonoIsotopic Mass | 318.121572 | |
| Topological Polar Surface Area | 112 | |
| Heavy Atom Count | 23 | |
| Formal Charge | 0 | |
| Complexity | 460 | |
| 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 | |
| Feature 3D Acceptor Count | 4 | |
| Feature 3D Donor Count | 1 | |
| Feature 3D Anion Count | 2 | |
| Feature 3D Ring Count | 5 | |
| Effective Rotor Count | 4.2 | |
| Conformer Sampling RMSD | 0.8 | |
| CID Conformer Count | 1 |
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