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Bicyclo[2.2.2]octane, 1-chloro-4-phenyl-
TL;DR: Bicyclo[2.2.2]octane, 1-chloro-4-phenyl- (CAS 33732-68-2) is a chemical compound with molecular formula C14H17Cl and molecular weight 220.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-phenylbicyclo[2.2.2]octane
Also Known As: Bicyclo[2.2.2]octane, 1-chloro-4-phenyl-, 1-Chloro-4-phenylbicyclo[2.2.2]octane, 4-chloro-1-phenylbicyclo[2.2.2]octane, ClC12CCC(CC1)(CC2)c3ccccc3, 1-Chloro-4-phenyl-bicyclo[2.2.2]octane
| Molecular Formula | C14H17Cl |
|---|---|
| Molecular Weight | 220.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.10188 |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 33732-68-2 |
|---|---|
| SMILES | C1CC2(CCC1(CC2)C3=CC=CC=C3)Cl |
| InChIKey | ZHWPZWVGLRJGPD-UHFFFAOYSA-N |
Product Overview
Bicyclo[2.2.2]octane, 1-chloro-4-phenyl- (CAS 33732-68-2), with molecular formula C14H17Cl and molecular weight 220.10 g/mol. IUPAC: 1-chloro-4-phenylbicyclo[2.2.2]octane.
Chemical Property Profile of Bicyclo[2.2.2]octane, 1-chloro-4-phenyl-
Property Insights of Bicyclo[2.2.2]octane, 1-chloro-4-phenyl-
The XLogP value of 4.1 indicates that Bicyclo[2.2.2]octane, 1-chloro-4-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Bicyclo[2.2.2]octane, 1-chloro-4-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[2.2.2]octane, 1-chloro-4-phenyl- has 0 hydrogen bond donor(s) and 0 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 Bicyclo[2.2.2]octane, 1-chloro-4-phenyl-?
The CAS number of Bicyclo[2.2.2]octane, 1-chloro-4-phenyl- is 33732-68-2.
What is the molecular formula of Bicyclo[2.2.2]octane, 1-chloro-4-phenyl-?
The molecular formula of Bicyclo[2.2.2]octane, 1-chloro-4-phenyl- is C14H17Cl.
What is the molecular weight of Bicyclo[2.2.2]octane, 1-chloro-4-phenyl-?
The molecular weight of Bicyclo[2.2.2]octane, 1-chloro-4-phenyl- is 220.10 g/mol.
Where can I buy Bicyclo[2.2.2]octane, 1-chloro-4-phenyl-?
You can request a quote for Bicyclo[2.2.2]octane, 1-chloro-4-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[2.2.2]octane, 1-chloro-4-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[2.2.2]octane, 1-chloro-4-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.