(-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid
TL;DR: (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid (CAS 97534-82-2) is a chemical compound with molecular formula C12H13NO5 and molecular weight 251.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S)-3-phenylmethoxycarbonyl-1,3-oxazolidine-4-carboxylic acid
Also Known As: (S)-CBZ-Oxaproline, (S)-3-((Benzyloxy)carbonyl)oxazolidine-4-carboxylic acid, N-Cbz-4-oxa-L-proline, (S)-Z-OXAPROLINE, S-N-Benzyloxycarbonyl-oxaproline
| Molecular Formula | C12H13NO5 |
|---|---|
| Molecular Weight | 251.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.07938 |
| Heavy Atoms | 18 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 97534-82-2 |
|---|---|
| SMILES | C1[C@H](N(CO1)C(=O)OCC2=CC=CC=C2)C(=O)O |
| InChIKey | XRRRGBIMHQARMF-JTQLQIEISA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid (CAS 97534-82-2), with molecular formula C12H13NO5 and molecular weight 251.08 g/mol. IUPAC: (4S)-3-phenylmethoxycarbonyl-1,3-oxazolidine-4-carboxylic acid.
Chemical Property Profile of (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid
Property Insights of (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid. Following Lipinski's Rule of Five, (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid?
The CAS number of (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid is 97534-82-2.
What is the molecular formula of (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid?
The molecular formula of (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid is C12H13NO5.
What is the molecular weight of (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid?
The molecular weight of (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid is 251.08 g/mol.
Where can I buy (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid?
You can request a quote for (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (-)-3-(Benzyloxycarbonyl)-4-oxazolidinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.