3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate
TL;DR: 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate (CAS 80399-26-4) is a chemical compound with molecular formula C42H54O6 and molecular weight 654.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyacetyl]oxy-3,4-dihydrobenzo[a]anthracen-3-yl] 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyacetate
Also Known As: 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate, 3,4-dihydrotetraphene-3,4-diyl bis({[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}acetate), [4-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyacetyl]oxy-3,4-dihydrobenzo[a]anthracen-3-yl] 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyacetate, Acetic acid, ((5-methyl-2-(1-methylethyl)cyclohexyl)oxy)-, 3,4-dihydrobenz(a)anthracene-3,4-diyl ester, (1R-(1alpha(3R*,4R*(1R*,2S*,5R*)),2beta,5alpha))-, Acetic acid, ((5-methyl-2-(1-methylethyl)cyclohexyl)oxy)-, 3,4-dihydrobenz(a)anthracene-3,4-diyl ester, (1R-(1alpha(3S*,4S*(1R*,2S*,5R*)),2beta,5alpha))-
| Molecular Formula | C42H54O6 |
|---|---|
| Molecular Weight | 654.39 g/mol |
| LogP | 10.9 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 654.392 |
| Heavy Atoms | 48 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 80399-26-4 |
|---|---|
| SMILES | CC1CCC(C(C1)OCC(=O)OC2C=CC3=C(C2OC(=O)COC4CC(CCC4C(C)C)C)C=CC5=CC6=CC=CC=C6C=C53)C(C)C |
| InChIKey | OLHQPSXAMPODBA-UHFFFAOYSA-N |
Product Overview
3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate (CAS 80399-26-4), with molecular formula C42H54O6 and molecular weight 654.39 g/mol. IUPAC: [4-[2-(5-methyl-2-propan-2-ylcyclohexyl)oxyacetyl]oxy-3,4-dihydrobenzo[a]anthracen-3-yl] 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyacetate.
Chemical Property Profile of 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate
Property Insights of 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate
The XLogP value of 10.9 indicates that 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate. Following Lipinski's Rule of Five, 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate?
The CAS number of 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate is 80399-26-4.
What is the molecular formula of 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate?
The molecular formula of 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate is C42H54O6.
What is the molecular weight of 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate?
The molecular weight of 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate is 654.39 g/mol.
Where can I buy 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate?
You can request a quote for 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dihydrotetraphene-3,4-diyl bis(((5-methyl-2-(propan-2-yl)cyclohexyl)oxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.