p-Butoxybenzyl chloride
TL;DR: p-Butoxybenzyl chloride (CAS 40141-13-7) is a chemical compound with molecular formula C11H15ClO and molecular weight 198.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butoxy-4-(chloromethyl)benzene
Also Known As: p-Butoxybenzyl chloride, 1-butoxy-4-(chloromethyl)benzene, 4-Butoxybenzyl Chloride, 4-n-butyloxybenzyl chloride
| Molecular Formula | C11H15ClO |
|---|---|
| Molecular Weight | 198.08 g/mol |
| LogP | 3.6043 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 198.08115 |
| Heavy Atoms | 13 |
| Complexity | 230.35052 |
Chemical Identifiers
| CAS Number | 40141-13-7 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)CCl |
Product Overview
p-Butoxybenzyl chloride (CAS 40141-13-7), with molecular formula C11H15ClO and molecular weight 198.08 g/mol. IUPAC: 1-butoxy-4-(chloromethyl)benzene.
Chemical Property Profile of p-Butoxybenzyl chloride
Property Insights of p-Butoxybenzyl chloride
The XLogP value of 3.6043 indicates that p-Butoxybenzyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, p-Butoxybenzyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Butoxybenzyl chloride has 0 hydrogen bond donor(s) and 1 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 p-Butoxybenzyl chloride?
The CAS number of p-Butoxybenzyl chloride is 40141-13-7.
What is the molecular formula of p-Butoxybenzyl chloride?
The molecular formula of p-Butoxybenzyl chloride is C11H15ClO.
What is the molecular weight of p-Butoxybenzyl chloride?
The molecular weight of p-Butoxybenzyl chloride is 198.08 g/mol.
Where can I buy p-Butoxybenzyl chloride?
You can request a quote for p-Butoxybenzyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Butoxybenzyl chloride?
Yes, KEHONG BIO provides custom synthesis services for p-Butoxybenzyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.