InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H
TL;DR: InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H (CAS 40164-34-9) is a chemical compound with molecular formula C8H13ClO and molecular weight 160.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-9-oxabicyclo[3.3.1]nonane
Also Known As: 1-chloro-9-oxabicyclo[3.3.1]nonane, 5-chloro-9-oxabicyclo[3.3.1]nonane, InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H
| Molecular Formula | C8H13ClO |
|---|---|
| Molecular Weight | 160.07 g/mol |
| LogP | 2.6745 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 160.06549 |
| Heavy Atoms | 10 |
| Complexity | 125.219284 |
Chemical Identifiers
| CAS Number | 40164-34-9 |
|---|---|
| SMILES | C1CC2CCCC(C1)(O2)Cl |
Product Overview
InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H (CAS 40164-34-9), with molecular formula C8H13ClO and molecular weight 160.07 g/mol. IUPAC: 1-chloro-9-oxabicyclo[3.3.1]nonane.
Chemical Property Profile of InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H
Property Insights of InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H
The XLogP value of 2.6745 suggests moderate lipophilicity, balancing water solubility and membrane permeability for InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H. With a topological polar surface area (TPSA) of 9.23 Ų, InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H 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 InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H?
The CAS number of InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H is 40164-34-9.
What is the molecular formula of InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H?
The molecular formula of InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H is C8H13ClO.
What is the molecular weight of InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H?
The molecular weight of InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H is 160.07 g/mol.
Where can I buy InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H?
You can request a quote for InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H?
Yes, KEHONG BIO provides custom synthesis services for InChI=1/C8H13ClO/c9-8-5-1-3-7(10-8)4-2-6-8/h7H,1-6H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.