Benzyl 2-(hydroxyamino)acetate
TL;DR: Benzyl 2-(hydroxyamino)acetate (CAS 58581-52-5) is a chemical compound with molecular formula C9H11NO3 and molecular weight 181.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-(hydroxyamino)acetate
Also Known As: benzyl 2-(hydroxyamino)acetate, Benzyl N-hydroxyglycinate, N-Hydroxyglycine benzyl ester, (Hydroxyamino)acetic acid benzyl ester, 1-(Benzyloxycarbonyl)-methylhydroxylamine
| Molecular Formula | C9H11NO3 |
|---|---|
| Molecular Weight | 181.07 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 181.0739 |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 58581-52-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CNO |
| InChIKey | OCDNPWULCRNKDC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl 2-(hydroxyamino)acetate (CAS 58581-52-5), with molecular formula C9H11NO3 and molecular weight 181.07 g/mol. IUPAC: benzyl 2-(hydroxyamino)acetate.
Chemical Property Profile of Benzyl 2-(hydroxyamino)acetate
Property Insights of Benzyl 2-(hydroxyamino)acetate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl 2-(hydroxyamino)acetate. With a topological polar surface area (TPSA) of 58.6 Ų, Benzyl 2-(hydroxyamino)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 2-(hydroxyamino)acetate has 2 hydrogen bond donor(s) and 4 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 Benzyl 2-(hydroxyamino)acetate?
The CAS number of Benzyl 2-(hydroxyamino)acetate is 58581-52-5.
What is the molecular formula of Benzyl 2-(hydroxyamino)acetate?
The molecular formula of Benzyl 2-(hydroxyamino)acetate is C9H11NO3.
What is the molecular weight of Benzyl 2-(hydroxyamino)acetate?
The molecular weight of Benzyl 2-(hydroxyamino)acetate is 181.07 g/mol.
Where can I buy Benzyl 2-(hydroxyamino)acetate?
You can request a quote for Benzyl 2-(hydroxyamino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 2-(hydroxyamino)acetate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 2-(hydroxyamino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.