1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy-
TL;DR: 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy- (CAS 68109-93-3) is a chemical compound with molecular formula C16H6Br2O4 and molecular weight 419.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,7-dibromo-3,8-dihydroxypyrene-1,6-dione
Also Known As: 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy-, 2,7-Dibromo-3,6-dihydroxy-1,8-pyrenedione, 2,7-Dibromo-3,6-dihydroxypyrene-1,8-dione, 2,7-dibromo-3,8-dihydroxypyrene-1,6-dione, 2,7-dibromo-3,6-dihydroxy-1,8-dihydropyrene-1,8-dione
| Molecular Formula | C16H6Br2O4 |
|---|---|
| Molecular Weight | 419.86 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 421.86124 |
| Heavy Atoms | 22 |
| Complexity | 595.0 |
Chemical Identifiers
| CAS Number | 68109-93-3 |
|---|---|
| SMILES | C1=CC2=C3C(=CC=C4C3=C1C(=C(C4=O)Br)O)C(=C(C2=O)Br)O |
| InChIKey | SKXPWQOMASBOCP-UHFFFAOYSA-N |
Product Overview
1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy- (CAS 68109-93-3), with molecular formula C16H6Br2O4 and molecular weight 419.86 g/mol. IUPAC: 2,7-dibromo-3,8-dihydroxypyrene-1,6-dione.
Chemical Property Profile of 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy-
Property Insights of 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy-
The XLogP value of 3.7 indicates that 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy-. Following Lipinski's Rule of Five, 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy- has 2 hydrogen bond donor(s) and 4 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 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy-?
The CAS number of 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy- is 68109-93-3.
What is the molecular formula of 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy-?
The molecular formula of 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy- is C16H6Br2O4.
What is the molecular weight of 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy-?
The molecular weight of 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy- is 419.86 g/mol.
Where can I buy 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy-?
You can request a quote for 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 1,8-Pyrenedione, 2,7-dibromo-3,6-dihydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.