1,9-二氯壬烷
TL;DR: 1,9-二氯壬烷 (CAS 821-99-8) is a chemical compound with molecular formula C9H18Cl2 and molecular weight 196.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,9-二氯壬烷
1,9-dichlorononane
Also Known As: 1,9-DICHLORONONANE, Nonane, 1,9-dichloro-, Nonane,9-dichloro-, 1,9-dichloro-nonane, NSC 9477;
| Molecular Formula | C9H18Cl2 |
|---|---|
| Molecular Weight | 196.08 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 8 |
| Exact Mass | 196.07855 |
| Heavy Atoms | 11 |
| Complexity | 56.0 |
Chemical Identifiers
| CAS Number | 821-99-8 |
|---|---|
| SMILES | C(CCCCCl)CCCCCl |
| InChIKey | JMGRNJZUQCEJDB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,9-二氯壬烷 (CAS 821-99-8), with molecular formula C9H18Cl2 and molecular weight 196.08 g/mol. IUPAC: 1,9-dichlorononane.
Chemical Property Profile of 1,9-二氯壬烷
Property Insights of 1,9-二氯壬烷
The XLogP value of 4.9 indicates that 1,9-二氯壬烷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,9-二氯壬烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,9-二氯壬烷 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 1,9-二氯壬烷?
The CAS number of 1,9-二氯壬烷 is 821-99-8.
What is the molecular formula of 1,9-二氯壬烷?
The molecular formula of 1,9-二氯壬烷 is C9H18Cl2.
What is the molecular weight of 1,9-二氯壬烷?
The molecular weight of 1,9-二氯壬烷 is 196.08 g/mol.
Where can I buy 1,9-二氯壬烷?
You can request a quote for 1,9-二氯壬烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,9-二氯壬烷?
Yes, KEHONG BIO provides custom synthesis services for 1,9-二氯壬烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.