N-Carboxybenzyl-Glycine | SBID = 199 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 75.6 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 1.0 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 2.0 | ||
| Number of H-Bond Acceptors: | 4.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 160.6 | ||
| Sum Formula: | C10H11NO4 | ||
| M / g/mol: | 209.201 | ||
| Complexity: | 224.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags: aminoacid derivative
- Name: N-Carboxybenzyl-Glycine
- Preferred Abbreviation: N-CBZ-glycine
- IUPAC Name: 2-(phenylmethoxycarbonylamino)acetic acid
- CAS: 1138-80-3
- CID: 14349
- InChiKey: CJUMAFVKTCBCJK-UHFFFAOYSA-N
- InChi: InChI=1S/C10H11NO4/c12-9(13)6-11-10(14)15-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13)
- CanoSmiles: C1=CC=C(C=C1)COC(=O)NCC(=O)O
- IsoSmiles: C1=CC=C(C=C1)COC(=O)NCC(=O)O
