2-acetamido-2-phenylacetic acid | SBID = 2542 | Compound |
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | 66.4 | ||
| Ertl TPSA/Å2: | 66.4 | ||
| Hydrophilicity (PubChem XLogP): | 0.8 | ||
| Hydrophilicity (Cheng XLogP3): | 1.71 | ||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 2.0 | ||
| Number of H-Bond Acceptors: | 3.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 1.0 | ||
| 3D Volume/Å3: | 151.3 | ||
| Sum Formula: | C10H11NO3 | ||
| M / g/mol: | 193.2 | ||
| Complexity: | 221.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags:
- Name: 2-acetamido-2-phenylacetic acid
- Preferred Abbreviation: 2-acetamido-2-phenylacetic acid
- IUPAC Name: 2-acetamido-2-phenylacetic acid
- CAS:
- CID: 85935
- InChiKey: VKDFZMMOLPIWQQ-UHFFFAOYSA-N
- InChi: InChI=1S/C10H11NO3/c1-7(12)11-9(10(13)14)8-5-3-2-4-6-8/h2-6,9H,1H3,(H,11,12)(H,13,14)
- CanoSmiles: CC(=O)NC(C1=CC=CC=C1)C(=O)O
- IsoSmiles: CC(=O)NC(C1=CC=CC=C1)C(=O)O
