9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene
TL;DR: 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene (CAS 39623-22-8) is a chemical compound with molecular formula C11H12Cl2 and molecular weight 214.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11,11-dichlorotricyclo[4.4.1.01,6]undeca-3,8-diene
Also Known As: J1.412.431D, 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene, 11.11-Dichlor-tricyclo[4.4.1.01,6]undeca-3,8-dien, 9,9-Dichloro-1,4,5,8-tetrahydro-4aalpha,8aalpha-methanonaphthalene, 9,9-Dichloro-1,4,5,8-tetrahydro-4abeta,8abeta-methanonaphthalene
| Molecular Formula | C11H12Cl2 |
|---|---|
| Molecular Weight | 214.03 g/mol |
| LogP | 3.8467 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 214.0316 |
| Heavy Atoms | 13 |
| Complexity | 266.05197 |
Chemical Identifiers
| CAS Number | 39623-22-8 |
|---|---|
| SMILES | C1C=CCC23C1(C2(Cl)Cl)CC=CC3 |
Product Overview
9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene (CAS 39623-22-8), with molecular formula C11H12Cl2 and molecular weight 214.03 g/mol. IUPAC: 11,11-dichlorotricyclo[4.4.1.01,6]undeca-3,8-diene.
Chemical Property Profile of 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene
Property Insights of 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene
The XLogP value of 3.8467 indicates that 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene 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 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene?
The CAS number of 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene is 39623-22-8.
What is the molecular formula of 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene?
The molecular formula of 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene is C11H12Cl2.
What is the molecular weight of 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene?
The molecular weight of 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene is 214.03 g/mol.
Where can I buy 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene?
You can request a quote for 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 9,9-Dichloro-1,4,5,8-tetrahydro-4a,8a-methanonaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.