![8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one structure](/static/products/5650/56509-56-9.webp)
8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one
TL;DR: 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one (CAS 56509-56-9) is a chemical compound with molecular formula C11H13BrO and molecular weight 240.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-bromotetracyclo[6.3.0.02,6.05,9]undecan-3-one
Also Known As: J2.200.243K, 8-bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one, 11-bromotetracyclo[6.3.0.02,6.05,9]undecan-3-one, 7-Bromotetracyclo[6.3.0.04,11.05,9]undecane-2-one, 8-bromohexahydro-1,5,4-(epipropane[1,1,3]triyl)pentalen-2(1H)-one
| Molecular Formula | C11H13BrO |
|---|---|
| Molecular Weight | 240.01 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.01498 |
| Heavy Atoms | 13 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 56509-56-9 |
|---|---|
| SMILES | C1C2C3CC(C2C4C1C3CC4=O)Br |
| InChIKey | MXVLNNRANFLZHC-UHFFFAOYSA-N |
Product Overview
8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one (CAS 56509-56-9), with molecular formula C11H13BrO and molecular weight 240.01 g/mol. IUPAC: 11-bromotetracyclo[6.3.0.02,6.05,9]undecan-3-one.
Chemical Property Profile of 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one
Property Insights of 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one. With a topological polar surface area (TPSA) of 17.1 Ų, 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one 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 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one?
The CAS number of 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one is 56509-56-9.
What is the molecular formula of 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one?
The molecular formula of 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one is C11H13BrO.
What is the molecular weight of 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one?
The molecular weight of 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one is 240.01 g/mol.
Where can I buy 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one?
You can request a quote for 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one?
Yes, KEHONG BIO provides custom synthesis services for 8-Bromohexahydro-2,4,1-(propane[1,1,3]triyl)pentalen-5(1h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.