6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
TL;DR: 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one (CAS 25040-10-2) is a chemical compound with molecular formula C11H10Br2O and molecular weight 315.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,9-dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
Also Known As: 6,9-dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one, 5H-benzocyclohepten-5-one,6,9-dibromo-6,7,8,9-tetrahydro-, 6,9-Dibromo-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one
| Molecular Formula | C11H10Br2O |
|---|---|
| Molecular Weight | 315.91 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 315.90985 |
| Heavy Atoms | 14 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 25040-10-2 |
|---|---|
| SMILES | C1CC(C(=O)C2=CC=CC=C2C1Br)Br |
| InChIKey | QYHWAMRKLJNNLG-UHFFFAOYSA-N |
Product Overview
6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one (CAS 25040-10-2), with molecular formula C11H10Br2O and molecular weight 315.91 g/mol. IUPAC: 6,9-dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one.
Chemical Property Profile of 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
Property Insights of 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
The XLogP value of 3.6 indicates that 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-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 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one?
The CAS number of 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one is 25040-10-2.
What is the molecular formula of 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one?
The molecular formula of 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one is C11H10Br2O.
What is the molecular weight of 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one?
The molecular weight of 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one is 315.91 g/mol.
Where can I buy 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one?
You can request a quote for 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one?
Yes, KEHONG BIO provides custom synthesis services for 6,9-Dibromo-6,7,8,9-tetrahydrobenzo[7]annulen-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.