5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-
TL;DR: 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl- (CAS 6244-20-8) is a chemical compound with molecular formula C18H27BrO2 and molecular weight 354.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-bromo-1-hydroxy-5,5,9,11,11-pentamethyltricyclo[7.3.1.02,7]tridec-2(7)-en-3-one
Also Known As: 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-, 8-bromo-1-hydroxy-5,5,9,11,11-pentamethyltricyclo[7.3.1.02,7]tridec-2(7)-en-3-one, 10-Bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-5,9-methanobenzocycloocten-4 -one, 10-Bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-5,9-methanobenzocycloocten-4(1H)-one
| Molecular Formula | C18H27BrO2 |
|---|---|
| Molecular Weight | 354.12 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 354.11945 |
| Heavy Atoms | 21 |
| Complexity | 545.0 |
Chemical Identifiers
| CAS Number | 6244-20-8 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)C3(CC(CC(C3)(C2Br)C)(C)C)O)C |
| InChIKey | FSFXQVVJDNRGBL-UHFFFAOYSA-N |
Product Overview
5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl- (CAS 6244-20-8), with molecular formula C18H27BrO2 and molecular weight 354.12 g/mol. IUPAC: 8-bromo-1-hydroxy-5,5,9,11,11-pentamethyltricyclo[7.3.1.02,7]tridec-2(7)-en-3-one.
Chemical Property Profile of 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-
Property Insights of 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-
The XLogP value of 3.3 indicates that 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl- has 1 hydrogen bond donor(s) and 2 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 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-?
The CAS number of 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl- is 6244-20-8.
What is the molecular formula of 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-?
The molecular formula of 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl- is C18H27BrO2.
What is the molecular weight of 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-?
The molecular weight of 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl- is 354.12 g/mol.
Where can I buy 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-?
You can request a quote for 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl-?
Yes, KEHONG BIO provides custom synthesis services for 5,9-Methanobenzocycloocten-4(1H)-one, 10-bromo-2,3,5,6,7,8,9,10-octahydro-5-hydroxy-2,2,7,7,9-pentamethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.