Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate
TL;DR: Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate (CAS 72597-18-3) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate
Also Known As: Cbz-D-prolinol, Cbz-DL-Prolinol, Pentapiperide, Z-Prolinol, Cbz-L-Prolinol
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 1.7799 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 366.18713 |
Chemical Identifiers
| CAS Number | 72597-18-3 |
|---|---|
| SMILES | C1CC(N(C1)C(=O)OCC2=CC=CC=C2)CO |
Product Overview
Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate (CAS 72597-18-3), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate.
Chemical Property Profile of Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate
Property Insights of Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate
The XLogP value of 1.7799 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate. With a topological polar surface area (TPSA) of 49.77 Ų, Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate has 1 hydrogen bond donor(s) and 3 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-(hydroxymethyl)pyrrolidine-1-carboxylate?
The CAS number of Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate is 72597-18-3.
What is the molecular formula of Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate?
The molecular formula of Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate is C13H17NO3.
What is the molecular weight of Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate?
The molecular weight of Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate is 235.12 g/mol.
Where can I buy Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate?
You can request a quote for Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.