![3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate structure](/static/products/7224/7224-48-8.webp)
3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate
TL;DR: 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate (CAS 7224-48-8) is a chemical compound with molecular formula C28H37BrO8S and molecular weight 612.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[11-[1-(4-bromophenyl)sulfonyloxypropan-2-yl]-3,14-dihydroxy-3,7,10-trimethyl-15-oxapentacyclo[7.5.1.02,6.07,13.010,14]pentadecan-9-yl] acetate
Also Known As: 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate
| Molecular Formula | C28H37BrO8S |
|---|---|
| Molecular Weight | 612.14 g/mol |
| LogP | 4.023 |
| Topological Polar Surface Area | 119.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 612.1392 |
| Heavy Atoms | 38 |
| Complexity | 1282.0228 |
Chemical Identifiers
| CAS Number | 7224-48-8 |
|---|---|
| SMILES | CC(COS(=O)(=O)C1=CC=C(C=C1)Br)C2CC3C4(CC5(C2(C3(C(O5)C6C4CCC6(C)O)O)C)OC(=O)C)C |
Product Overview
3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate (CAS 7224-48-8), with molecular formula C28H37BrO8S and molecular weight 612.14 g/mol. IUPAC: [11-[1-(4-bromophenyl)sulfonyloxypropan-2-yl]-3,14-dihydroxy-3,7,10-trimethyl-15-oxapentacyclo[7.5.1.02,6.07,13.010,14]pentadecan-9-yl] acetate.
Chemical Property Profile of 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate
Property Insights of 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate
The XLogP value of 4.023 indicates that 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate. Following Lipinski's Rule of Five, 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate?
The CAS number of 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate is 7224-48-8.
What is the molecular formula of 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate?
The molecular formula of 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate is C28H37BrO8S.
What is the molecular weight of 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate?
The molecular weight of 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate is 612.14 g/mol.
Where can I buy 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate?
You can request a quote for 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-{1-[(4-Bromobenzene-1-sulfonyl)oxy]propan-2-yl}-8,8c-dihydroxy-2a,5,8-trimethyldodecahydro-2H-2,5-methano-s-indaceno[8,1-bc]furan-2-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.