Benzyl 4-(bromomethyl)piperidine-1-carboxylate
TL;DR: Benzyl 4-(bromomethyl)piperidine-1-carboxylate (CAS 399580-55-3) is a chemical compound with molecular formula C14H18BrNO2 and molecular weight 311.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 4-(bromomethyl)piperidine-1-carboxylate
Also Known As: Benzyl 4-(bromomethyl)piperidine-1-carboxylate, Benzyl 4-(Bromomethyl)Tetrahydro-1(2H)-Pyridinecarboxylate, 1-Cbz-4-(Bromomethyl)piperidine, N-CBZ-4-(BROMOMETHYL)PIPERIDINE, BUTTPARK 95\50-67
| Molecular Formula | C14H18BrNO2 |
|---|---|
| Molecular Weight | 311.05 g/mol |
| LogP | 3.4301 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.0521 |
| Heavy Atoms | 18 |
| Complexity | 374.6402 |
Chemical Identifiers
| CAS Number | 399580-55-3 |
|---|---|
| SMILES | C1CN(CCC1CBr)C(=O)OCC2=CC=CC=C2 |
Product Overview
Benzyl 4-(bromomethyl)piperidine-1-carboxylate (CAS 399580-55-3), with molecular formula C14H18BrNO2 and molecular weight 311.05 g/mol. IUPAC: benzyl 4-(bromomethyl)piperidine-1-carboxylate.
Chemical Property Profile of Benzyl 4-(bromomethyl)piperidine-1-carboxylate
Property Insights of Benzyl 4-(bromomethyl)piperidine-1-carboxylate
The XLogP value of 3.4301 indicates that Benzyl 4-(bromomethyl)piperidine-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, Benzyl 4-(bromomethyl)piperidine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 4-(bromomethyl)piperidine-1-carboxylate has 0 hydrogen bond donor(s) and 2 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 4-(bromomethyl)piperidine-1-carboxylate?
The CAS number of Benzyl 4-(bromomethyl)piperidine-1-carboxylate is 399580-55-3.
What is the molecular formula of Benzyl 4-(bromomethyl)piperidine-1-carboxylate?
The molecular formula of Benzyl 4-(bromomethyl)piperidine-1-carboxylate is C14H18BrNO2.
What is the molecular weight of Benzyl 4-(bromomethyl)piperidine-1-carboxylate?
The molecular weight of Benzyl 4-(bromomethyl)piperidine-1-carboxylate is 311.05 g/mol.
Where can I buy Benzyl 4-(bromomethyl)piperidine-1-carboxylate?
You can request a quote for Benzyl 4-(bromomethyl)piperidine-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 4-(bromomethyl)piperidine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 4-(bromomethyl)piperidine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.