9-tert-Butyl-9,10-(dewar anthracene)
TL;DR: 9-tert-Butyl-9,10-(dewar anthracene) (CAS 76008-29-2) is a chemical compound with molecular formula C18H18 and molecular weight 234.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyltetracyclo[6.6.0.02,7.09,14]tetradeca-2,4,6,9,11,13-hexaene
Also Known As: 9-tert-Butyl-9,10-(dewar anthracene), Benzo(3',4')cyclobuta(1',2':3,4)cyclobuta(1,2)benzene, 4b-(1,1-dimethylethyl)-4b,8b-dihydro-, 4b-tert-Butyl-4b,8b-dihydrobenzo[3',4']cyclobuta[1',2':3,4]cyclobuta[1,2]benzene, RefChem:326027
| Molecular Formula | C18H18 |
|---|---|
| Molecular Weight | 234.14 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 234.14085 |
| Heavy Atoms | 18 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 76008-29-2 |
|---|---|
| SMILES | CC(C)(C)C12C(C3=CC=CC=C31)C4=CC=CC=C24 |
| InChIKey | ISMYYTMVFOAZIS-UHFFFAOYSA-N |
Product Overview
9-tert-Butyl-9,10-(dewar anthracene) (CAS 76008-29-2), with molecular formula C18H18 and molecular weight 234.14 g/mol. IUPAC: 1-tert-butyltetracyclo[6.6.0.02,7.09,14]tetradeca-2,4,6,9,11,13-hexaene.
Chemical Property Profile of 9-tert-Butyl-9,10-(dewar anthracene)
Property Insights of 9-tert-Butyl-9,10-(dewar anthracene)
The XLogP value of 4.0 indicates that 9-tert-Butyl-9,10-(dewar anthracene) 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-tert-Butyl-9,10-(dewar anthracene) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-tert-Butyl-9,10-(dewar anthracene) 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-tert-Butyl-9,10-(dewar anthracene)?
The CAS number of 9-tert-Butyl-9,10-(dewar anthracene) is 76008-29-2.
What is the molecular formula of 9-tert-Butyl-9,10-(dewar anthracene)?
The molecular formula of 9-tert-Butyl-9,10-(dewar anthracene) is C18H18.
What is the molecular weight of 9-tert-Butyl-9,10-(dewar anthracene)?
The molecular weight of 9-tert-Butyl-9,10-(dewar anthracene) is 234.14 g/mol.
Where can I buy 9-tert-Butyl-9,10-(dewar anthracene)?
You can request a quote for 9-tert-Butyl-9,10-(dewar anthracene) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-tert-Butyl-9,10-(dewar anthracene)?
Yes, KEHONG BIO provides custom synthesis services for 9-tert-Butyl-9,10-(dewar anthracene) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.