chloramphenicol | SBID = 2343 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 115.0 | ||
| Ertl TPSA/Å2: | 115.38 | ||
| Hydrophilicity (PubChem XLogP): | 1.1 | ||
| Hydrophilicity (Cheng XLogP3): | 1.14 | ||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 3.0 | ||
| Number of H-Bond Acceptors: | 5.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 2.0 | ||
| 3D Volume/Å3: | 221.6 | ||
| Sum Formula: | C11H12Cl2N2O5 | ||
| M / g/mol: | 323.13 | ||
| Complexity: | 342.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags:
- Name: chloramphenicol
- Preferred Abbreviation: chloramphenicol
- IUPAC Name: 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide
- CAS:
- CID: 5959
- InChiKey: WIIZWVCIJKGZOK-RKDXNWHRSA-N
- InChi: InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m1/s1
- CanoSmiles: C1=CC(=CC=C1C(C(CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-]
- IsoSmiles: C1=CC(=CC=C1[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-]
