(9,10-Dioxoanthracen-1-yl) 2-methylbenzoate
TL;DR: (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate (CAS 486440-12-4) is a chemical compound with molecular formula C22H14O4 and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9,10-dioxoanthracen-1-yl) 2-methylbenzoate
Also Known As: (9,10-dioxoanthracen-1-yl) 2-methylbenzoate, 9,10-dioxo-9,10-dihydro-1-anthracenyl 2-methylbenzoate, AN-652/15522006
| Molecular Formula | C22H14O4 |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 3.98962 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.0892 |
| Heavy Atoms | 26 |
| Complexity | 1079.0052 |
Chemical Identifiers
| CAS Number | 486440-12-4 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)OC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O |
Product Overview
(9,10-Dioxoanthracen-1-yl) 2-methylbenzoate (CAS 486440-12-4), with molecular formula C22H14O4 and molecular weight 342.09 g/mol. IUPAC: (9,10-dioxoanthracen-1-yl) 2-methylbenzoate.
Chemical Property Profile of (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate
Property Insights of (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate
The XLogP value of 3.98962 indicates that (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate. Following Lipinski's Rule of Five, (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate has 0 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 (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate?
The CAS number of (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate is 486440-12-4.
What is the molecular formula of (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate?
The molecular formula of (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate is C22H14O4.
What is the molecular weight of (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate?
The molecular weight of (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate is 342.09 g/mol.
Where can I buy (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate?
You can request a quote for (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for (9,10-Dioxoanthracen-1-yl) 2-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.