Uracil | SBID = 600 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 58.2 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -1.1 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 2.0 | ||
| Number of H-Bond Acceptors: | 2.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 81.1 | ||
| Sum Formula: | C4H4N2O2 | ||
| M / g/mol: | 112.09 | ||
| Complexity: | 161.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags: nucleobase
- Name: Uracil
- Preferred Abbreviation: Uracil
- IUPAC Name: 1H-pyrimidine-2,4-dione
- CAS: 66-22-8
- CID: 1174
- InChiKey: ISAKRJDGNUQOIC-UHFFFAOYSA-N
- InChi: InChI=1S/C4H4N2O2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)
- CanoSmiles: C1=CNC(=O)NC1=O
- IsoSmiles: C1=CNC(=O)NC1=O
