2,2'-Dithienylmethane
TL;DR: 2,2'-Dithienylmethane (CAS 4341-22-4) is a chemical compound with molecular formula C16H22O and molecular weight 230.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,4R,6R)-4-tert-butyl-1-phenyl-7-oxabicyclo[4.1.0]heptane
Also Known As: 2,2'-Dithienylmethane, 4-t-Butyl-1-phenyl-7-oxabicyclo(4.1.0)heptane, 7-Oxabicyclo(4.1.0)heptane, 4-tert-butyl-1-phenyl-, cis-, 7-Oxabicyclo(4.1.0)heptane, 4-(1,1-dimethylethyl)-1-phenyl-, (1alpha,4beta,6alpha)-, (1R,4R,6R)-4-TERT-BUTYL-1-PHENYL-7-OXABICYCLO[4.1.0]HEPTANE
| Molecular Formula | C16H22O |
|---|---|
| Molecular Weight | 230.17 g/mol |
| LogP | 4.1269 |
| Topological Polar Surface Area | 12.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.16707 |
| Heavy Atoms | 17 |
| Complexity | 403.2834 |
Chemical Identifiers
| CAS Number | 4341-22-4 |
|---|---|
| SMILES | CC(C)(C)[C@@H]1CC[C@]2([C@@H](C1)O2)C3=CC=CC=C3 |
Product Overview
2,2'-Dithienylmethane (CAS 4341-22-4), with molecular formula C16H22O and molecular weight 230.17 g/mol. IUPAC: (1R,4R,6R)-4-tert-butyl-1-phenyl-7-oxabicyclo[4.1.0]heptane.
Chemical Property Profile of 2,2'-Dithienylmethane
Property Insights of 2,2'-Dithienylmethane
The XLogP value of 4.1269 indicates that 2,2'-Dithienylmethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.53 Ų, 2,2'-Dithienylmethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2'-Dithienylmethane 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 2,2'-Dithienylmethane?
The CAS number of 2,2'-Dithienylmethane is 4341-22-4.
What is the molecular formula of 2,2'-Dithienylmethane?
The molecular formula of 2,2'-Dithienylmethane is C16H22O.
What is the molecular weight of 2,2'-Dithienylmethane?
The molecular weight of 2,2'-Dithienylmethane is 230.17 g/mol.
Where can I buy 2,2'-Dithienylmethane?
You can request a quote for 2,2'-Dithienylmethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-Dithienylmethane?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-Dithienylmethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.