![7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate) structure](/static/products/7168/7168-09-4.webp)
7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate)
TL;DR: 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate) (CAS 7168-09-4) is a chemical compound with molecular formula C35H38Br2O7 and molecular weight 728.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(4-bromobenzoyl)oxy-3-(1,3-dioxolan-2-yl)-11,11,14-trimethyl-15-oxo-7-tetracyclo[7.5.1.01,5.010,12]pentadecanyl] 4-bromobenzoate
Also Known As: 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate)
| Molecular Formula | C35H38Br2O7 |
|---|---|
| Molecular Weight | 728.10 g/mol |
| LogP | 7.2491 |
| Topological Polar Surface Area | 88.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 728.09845 |
| Heavy Atoms | 44 |
| Complexity | 1450.4252 |
Chemical Identifiers
| CAS Number | 7168-09-4 |
|---|---|
| SMILES | CC1CC2C(C2(C)C)C3CC(C(C4C1(C3=O)CC(C4)C5OCCO5)OC(=O)C6=CC=C(C=C6)Br)OC(=O)C7=CC=C(C=C7)Br |
Product Overview
7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate) (CAS 7168-09-4), with molecular formula C35H38Br2O7 and molecular weight 728.10 g/mol. IUPAC: [6-(4-bromobenzoyl)oxy-3-(1,3-dioxolan-2-yl)-11,11,14-trimethyl-15-oxo-7-tetracyclo[7.5.1.01,5.010,12]pentadecanyl] 4-bromobenzoate.
Chemical Property Profile of 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate)
Property Insights of 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate)
The XLogP value of 7.2491 indicates that 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate). Following Lipinski's Rule of Five, 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate) has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate)?
The CAS number of 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate) is 7168-09-4.
What is the molecular formula of 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate)?
The molecular formula of 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate) is C35H38Br2O7.
What is the molecular weight of 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate)?
The molecular weight of 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate) is 728.10 g/mol.
Where can I buy 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate)?
You can request a quote for 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate)?
Yes, KEHONG BIO provides custom synthesis services for 7-(1,3-Dioxolan-2-yl)-1,1,9-trimethyl-11-oxododecahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulene-4,5-diyl bis(4-bromobenzoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.