![9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro- structure](/static/products/1469/14697-77-9.webp)
9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro-
TL;DR: 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro- (CAS 14697-77-9) is a chemical compound with molecular formula C8H11ClS and molecular weight 174.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-9-thiabicyclo[3.3.1]non-2-ene
Also Known As: 6-chloro-9-thiabicyclo[3.3.1]non-2-ene, 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro-
| Molecular Formula | C8H11ClS |
|---|---|
| Molecular Weight | 174.03 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.027 |
| Heavy Atoms | 10 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 14697-77-9 |
|---|---|
| SMILES | C1CC(C2CC=CC1S2)Cl |
| InChIKey | AMMGLXRNTZTJRO-UHFFFAOYSA-N |
Product Overview
9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro- (CAS 14697-77-9), with molecular formula C8H11ClS and molecular weight 174.03 g/mol. IUPAC: 6-chloro-9-thiabicyclo[3.3.1]non-2-ene.
Chemical Property Profile of 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro-
Property Insights of 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro-. With a topological polar surface area (TPSA) of 25.3 Ų, 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro- 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 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro-?
The CAS number of 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro- is 14697-77-9.
What is the molecular formula of 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro-?
The molecular formula of 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro- is C8H11ClS.
What is the molecular weight of 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro-?
The molecular weight of 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro- is 174.03 g/mol.
Where can I buy 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro-?
You can request a quote for 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro-?
Yes, KEHONG BIO provides custom synthesis services for 9-Thiabicyclo[3.3.1]non-2-ene, 6-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.