4-氯丁基苯基醚
TL;DR: 4-氯丁基苯基醚 (CAS 2651-46-9) is a chemical compound with molecular formula C10H13ClO and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氯丁基苯基醚
4-chlorobutoxybenzene
Also Known As: 4-Phenoxybutyl chloride, (4-Chlorobutoxy)benzene, 4-chlorobutoxybenzene, Benzene, (4-chlorobutoxy)-, 4-Chlorobutyl phenyl ether
| Molecular Formula | C10H13ClO |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 184.06549 |
| Heavy Atoms | 12 |
| Complexity | 100.0 |
Chemical Identifiers
| CAS Number | 2651-46-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCCCCCl |
| InChIKey | JKXCPAVECBFBOC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氯丁基苯基醚 (CAS 2651-46-9), with molecular formula C10H13ClO and molecular weight 184.07 g/mol. IUPAC: 4-chlorobutoxybenzene.
Chemical Property Profile of 4-氯丁基苯基醚
Property Insights of 4-氯丁基苯基醚
The XLogP value of 3.6 indicates that 4-氯丁基苯基醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 4-氯丁基苯基醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氯丁基苯基醚 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 4-氯丁基苯基醚?
The CAS number of 4-氯丁基苯基醚 is 2651-46-9.
What is the molecular formula of 4-氯丁基苯基醚?
The molecular formula of 4-氯丁基苯基醚 is C10H13ClO.
What is the molecular weight of 4-氯丁基苯基醚?
The molecular weight of 4-氯丁基苯基醚 is 184.07 g/mol.
Where can I buy 4-氯丁基苯基醚?
You can request a quote for 4-氯丁基苯基醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氯丁基苯基醚?
Yes, KEHONG BIO provides custom synthesis services for 4-氯丁基苯基醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.