2-(1-Piperidinyl)ethyl 2-bromobenzoate
TL;DR: 2-(1-Piperidinyl)ethyl 2-bromobenzoate (CAS 693224-37-2) 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.
2-piperidin-1-ylethyl 2-bromobenzoate
Also Known As: ChemDiv2_001639, 2-piperidin-1-ylethyl 2-bromobenzoate, 2-(1-piperidinyl)ethyl 2-bromobenzoate, 2-(piperidin-1-yl)ethyl 2-bromobenzoate, AO-365/40136282
| Molecular Formula | C14H18BrNO2 |
|---|---|
| Molecular Weight | 311.05 g/mol |
| LogP | 3.0918 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.0521 |
| Heavy Atoms | 18 |
| Complexity | 402.5354 |
Chemical Identifiers
| CAS Number | 693224-37-2 |
|---|---|
| SMILES | C1CCN(CC1)CCOC(=O)C2=CC=CC=C2Br |
Product Overview
2-(1-Piperidinyl)ethyl 2-bromobenzoate (CAS 693224-37-2), with molecular formula C14H18BrNO2 and molecular weight 311.05 g/mol. IUPAC: 2-piperidin-1-ylethyl 2-bromobenzoate.
Chemical Property Profile of 2-(1-Piperidinyl)ethyl 2-bromobenzoate
Property Insights of 2-(1-Piperidinyl)ethyl 2-bromobenzoate
The XLogP value of 3.0918 indicates that 2-(1-Piperidinyl)ethyl 2-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 2-(1-Piperidinyl)ethyl 2-bromobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Piperidinyl)ethyl 2-bromobenzoate has 0 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 2-(1-Piperidinyl)ethyl 2-bromobenzoate?
The CAS number of 2-(1-Piperidinyl)ethyl 2-bromobenzoate is 693224-37-2.
What is the molecular formula of 2-(1-Piperidinyl)ethyl 2-bromobenzoate?
The molecular formula of 2-(1-Piperidinyl)ethyl 2-bromobenzoate is C14H18BrNO2.
What is the molecular weight of 2-(1-Piperidinyl)ethyl 2-bromobenzoate?
The molecular weight of 2-(1-Piperidinyl)ethyl 2-bromobenzoate is 311.05 g/mol.
Where can I buy 2-(1-Piperidinyl)ethyl 2-bromobenzoate?
You can request a quote for 2-(1-Piperidinyl)ethyl 2-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Piperidinyl)ethyl 2-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Piperidinyl)ethyl 2-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.